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

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

  • Molecular FormulaC21H31FN2O3
  • Average mass378.481 Da
  • Monoisotopic mass378.231873 Da
  • ChemSpider ID68023910

More details:

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

2-Pyrrolidinecarboxamide, N-[[4-[(4,4-dimethylcyclohexyl)oxy]-5-fluoro-2-methoxyphenyl]methyl]- [ACD/Index Name]
N-{4-[(4,4-Dimethylcyclohexyl)oxy]-5-fluor-2-methoxybenzyl}prolinamid [German] [ACD/IUPAC Name]
N-{4-[(4,4-Dimethylcyclohexyl)oxy]-5-fluoro-2-methoxybenzyl}prolinamide [ACD/IUPAC Name]
N-{4-[(4,4-Diméthylcyclohexyl)oxy]-5-fluoro-2-méthoxybenzyl}prolinamide [French] [ACD/IUPAC Name]
MFCD25542387
N,N-Diethyl-3-(hydroxymethyl)benzamide [ACD/IUPAC Name]

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


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