N-ethyl-5-methyl-2-prop-1-en-2-ylcyclohexane-1-carboxamide

  • Identifiers

    Molecular formula
    C13H23NO

    SMILES
    CCNC(=O)C1CC(CCC1C(=C)C)C

  • Odor profile

    Fragrance
    Mint 53.27%
    Cooling 50.76%
    Herbal 33.82%
    Spicy 29.05%
    Grapefruit 28.73%
    Odorless 28.1%
    Savory 25.57%
    Citrus 23.32%
    Meaty 23.24%
    Fresh 21.39%

     

    Flavor
    Herbal 42.23%
    Minty 28.88%
    Herb 23.89%
    Spicy 22.39%
    Spice 21.17%
    Woody 21.05%
    Mint 20.58%
    Basil 20.5%
    Leaves 20.17%
    Cedarleaf 20.13%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.4

    pKa est.
    8.11 (weak base)

    Molecular weight
    209.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    311°C

    Flash point

    • 132.84 ˚C est.

  • Synonyms

    • SCHEMBL14742857
  • Applications

    N-ethyl-5-methyl-2-prop-1-en-2-ylcyclohexane-1-carboxamide may be used as a fragrance ingredient or fixative in perfumery, and as a scent component in cosmetics and personal care products; it can also appear in household products (air fresheners and cleaners) to contribute aroma profiles. In industrial manufacturing it serves as an intermediate for the synthesis of specialty chemicals and as a building block for polymers and coatings formulations, where the isopropenyl moiety provides synthetic versatility. The compound is commonly evaluated for applications in coatings/inks and as a chemical precursor in research-scale synthesis for pharma and agrochemical intermediates, subject to local regulations and formulation limits. CAS number:

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1479.5
    methanol 1887.23
    isopropanol 1497.55
    water 1.86
    ethyl acetate 281.51
    n-propanol 1172.98
    acetone 448.35
    n-butanol 1042.63
    acetonitrile 261.26
    DMF 813.12
    toluene 225.44
    isobutanol 807.57
    1,4-dioxane 849.73
    methyl acetate 230.74
    THF 1069.61
    2-butanone 366.17
    n-pentanol 549.7
    sec-butanol 769.11
    n-hexane 17.07
    ethylene glycol 188.14
    NMP 401.97
    cyclohexane 47.39
    DMSO 449.85
    n-butyl acetate 367.16
    n-octanol 160.15
    chloroform 1193.35
    n-propyl acetate 170.66
    acetic acid 589.61
    dichloromethane 699.92
    cyclohexanone 652.13
    propylene glycol 345.13
    isopropyl acetate 252.02
    DMAc 459.89
    2-ethoxyethanol 422.38
    isopentanol 708.75
    n-heptane 10.14
    ethyl formate 332.76
    1,2-dichloroethane 400.96
    n-hexanol 642.94
    2-methoxyethanol 899.7
    isobutyl acetate 153.01
    tetrachloromethane 132.58
    n-pentyl acetate 176.13
    transcutol 735.63
    n-heptanol 208.21
    ethylbenzene 97.72
    MIBK 223.31
    2-propoxyethanol 649.16
    tert-butanol 995.0
    MTBE 437.07
    2-butoxyethanol 322.98
    propionic acid 381.3
    o-xylene 119.03
    formic acid 236.65
    diethyl ether 327.48
    m-xylene 143.36
    p-xylene 126.52
    chlorobenzene 297.14
    dimethyl carbonate 66.32
    n-octane 6.09
    formamide 191.68
    cyclopentanone 600.93
    2-pentanone 326.32
    anisole 170.41
    cyclopentyl methyl ether 286.95
    gamma-butyrolactone 517.4
    1-methoxy-2-propanol 643.09
    pyridine 661.35
    3-pentanone 154.99
    furfural 559.46
    n-dodecane 6.14
    diethylene glycol 426.12
    diisopropyl ether 80.04
    tert-amyl alcohol 538.66
    acetylacetone 244.71
    n-hexadecane 7.2
    acetophenone 156.84
    methyl propionate 168.08
    isopentyl acetate 358.74
    trichloroethylene 761.31
    n-nonanol 135.66
    cyclohexanol 585.29
    benzyl alcohol 263.07
    2-ethylhexanol 218.16
    isooctanol 160.35
    dipropyl ether 119.99
    1,2-dichlorobenzene 217.97
    ethyl lactate 101.22
    propylene carbonate 342.16
    n-methylformamide 400.48
    2-pentanol 494.12
    n-pentane 22.27
    1-propoxy-2-propanol 428.73
    1-methoxy-2-propyl acetate 252.76
    2-(2-methoxypropoxy) propanol 192.61
    mesitylene 79.93
    ε-caprolactone 489.7
    p-cymene 70.34
    epichlorohydrin 616.96
    1,1,1-trichloroethane 360.78
    2-aminoethanol 503.7
    morpholine-4-carbaldehyde 486.78
    sulfolane 406.53
    2,2,4-trimethylpentane 16.02
    2-methyltetrahydrofuran 604.13
    n-hexyl acetate 211.43
    isooctane 13.66
    2-(2-butoxyethoxy)ethanol 298.81
    sec-butyl acetate 134.06
    tert-butyl acetate 212.6
    decalin 19.7
    glycerin 358.42
    diglyme 453.21
    acrylic acid 284.14
    isopropyl myristate 70.88
    n-butyric acid 772.54
    acetyl acetate 162.57
    di(2-ethylhexyl) phthalate 103.12
    ethyl propionate 119.05
    nitromethane 402.88
    1,2-diethoxyethane 252.78
    benzonitrile 325.76
    trioctyl phosphate 71.93
    1-bromopropane 309.69
    gamma-valerolactone 824.15
    n-decanol 94.17
    triethyl phosphate 69.97
    4-methyl-2-pentanol 247.49
    propionitrile 340.39
    vinylene carbonate 325.92
    1,1,2-trichlorotrifluoroethane 433.81
    DMS 115.27
    cumene 69.31
    2-octanol 133.39
    2-hexanone 201.22
    octyl acetate 95.41
    limonene 93.64
    1,2-dimethoxyethane 565.99
    ethyl orthosilicate 72.68
    tributyl phosphate 78.22
    diacetone alcohol 269.28
    N,N-dimethylaniline 112.23
    acrylonitrile 337.37
    aniline 370.19
    1,3-propanediol 801.05
    bromobenzene 265.71
    dibromomethane 479.61
    1,1,2,2-tetrachloroethane 634.4
    2-methyl-cyclohexyl acetate 135.65
    tetrabutyl urea 97.68
    diisobutyl methanol 111.21
    2-phenylethanol 293.35
    styrene 124.56
    dioctyl adipate 97.68
    dimethyl sulfate 93.52
    ethyl butyrate 157.86
    methyl lactate 134.93
    butyl lactate 168.71
    diethyl carbonate 100.39
    propanediol butyl ether 306.89
    triethyl orthoformate 118.4
    p-tert-butyltoluene 66.65
    methyl 4-tert-butylbenzoate 148.74
    morpholine 1116.47
    tert-butylamine 492.19
    n-dodecanol 66.3
    dimethoxymethane 330.55
    ethylene carbonate 284.52
    cyrene 175.06
    2-ethoxyethyl acetate 203.54
    2-ethylhexyl acetate 233.89
    1,2,4-trichlorobenzene 240.17
    4-methylpyridine 632.65
    dibutyl ether 106.58
    2,6-dimethyl-4-heptanol 111.21
    DEF 283.69
    dimethyl isosorbide 277.46
    tetrachloroethylene 420.42
    eugenol 177.67
    triacetin 135.15
    span 80 204.96
    1,4-butanediol 280.47
    1,1-dichloroethane 522.29
    2-methyl-1-pentanol 406.15
    methyl formate 256.54
    2-methyl-1-butanol 587.27
    n-decane 10.57
    butyronitrile 543.32
    3,7-dimethyl-1-octanol 149.3
    1-chlorooctane 65.68
    1-chlorotetradecane 23.25
    n-nonane 9.25
    undecane 7.71
    tert-butylcyclohexane 18.64
    cyclooctane 10.75
    cyclopentanol 582.15
    tetrahydropyran 896.1
    tert-amyl methyl ether 220.98
    2,5,8-trioxanonane 272.75
    1-hexene 110.98
    2-isopropoxyethanol 270.2
    2,2,2-trifluoroethanol 137.46
    methyl butyrate 206.53

    Scent© AI

1 of 4
Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
No restriction
Category 2
Products applied to the axillae
No restriction Category 7B
Leave-on products applied to the hair with some hand contact
No restriction
Category 3
Products applied to the face/body using fingertips
No restriction Category 8
Products with significant anogenital exposure
No restriction
Category 4
Products related to fine fragrance
No restriction Category 9
Products with body and hand exposure, primarily rinse off
No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
No restriction Category 10A
Household care products with mostly hand contact
No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
No restriction
Category 5D
Baby Creams, baby Oils and baby talc
No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
No restriction
Category 6
Products with oral and lip exposure
No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
No restriction