ChemSpider 2D Image | N-{4-[(4,4-Dimethylcyclohexyl)oxy]-5-fluoro-2-methoxybenzyl}-L-prolinamide | C21H31FN2O3

N-{4-[(4,4-Dimethylcyclohexyl)oxy]-5-fluoro-2-methoxybenzyl}-L-prolinamide

  • Molecular FormulaC21H31FN2O3
  • Average mass378.481 Da
  • Monoisotopic mass378.231873 Da
  • ChemSpider ID24676344

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(S)-N-(4-((4,4-DIMETHYLCYCLOHEXYL)OXY)-5-FLUORO-2-METHOXYBENZYL)PYRROLIDINE-2-CARBOXAMIDE
1224048-09-2 [RN]
2-Pyrrolidinecarboxamide, N-[[4-[(4,4-dimethylcyclohexyl)oxy]-5-fluoro-2-methoxyphenyl]methyl]-, (2S)- [ACD/Index Name]
N-{4-[(4,4-Dimethylcyclohexyl)oxy]-5-fluor-2-methoxybenzyl}-L-prolinamid [German] [ACD/IUPAC Name]
N-{4-[(4,4-Dimethylcyclohexyl)oxy]-5-fluoro-2-methoxybenzyl}-L-prolinamide [ACD/IUPAC Name]
N-{4-[(4,4-Diméthylcyclohexyl)oxy]-5-fluoro-2-méthoxybenzyl}-L-prolinamide [French] [ACD/IUPAC Name]
(2S)-N-[[4-(4,4-dimethylcyclohexyl)oxy-5-fluoro-2-methoxyphenyl]methyl]pyrrolidine-2-carboxamide
2-PyrrolidinecarboxaMide, N-[[4-[(4,4-diMethylcyclohexyl)oxy]-5-fluoro-2-Methoxyphenyl]Methyl]-, (2S
MFCD25542387
missing
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 560.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.3±3.0 kJ/mol
    Flash Point: 292.5±30.1 °C
    Index of Refraction: 1.519
    Molar Refractivity: 102.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.39
    ACD/LogD (pH 5.5): 0.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.45
    ACD/LogD (pH 7.4): 2.53
    ACD/BCF (pH 7.4): 29.43
    ACD/KOC (pH 7.4): 212.69
    Polar Surface Area: 60 Å2
    Polarizability: 40.7±0.5 10-24cm3
    Surface Tension: 38.6±3.0 dyne/cm
    Molar Volume: 338.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement