ChemSpider 2D Image | N-Cyclohexyl-1-{3-[(3,4-difluorobenzoyl)amino]benzyl}-4-piperidinecarboxamide | C26H31F2N3O2

N-Cyclohexyl-1-{3-[(3,4-difluorobenzoyl)amino]benzyl}-4-piperidinecarboxamide

  • Molecular FormulaC26H31F2N3O2
  • Average mass455.540 Da
  • Monoisotopic mass455.238434 Da
  • ChemSpider ID61732047

More details:






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

4-Piperidinecarboxamide, N-cyclohexyl-1-[[3-[(3,4-difluorobenzoyl)amino]phenyl]methyl]- [ACD/Index Name]
N-Cyclohexyl-1-{3-[(3,4-difluorbenzoyl)amino]benzyl}-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-Cyclohexyl-1-{3-[(3,4-difluorobenzoyl)amino]benzyl}-4-piperidinecarboxamide [ACD/IUPAC Name]
N-Cyclohexyl-1-{3-[(3,4-difluorobenzoyl)amino]benzyl}-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 575.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.1±3.0 kJ/mol
Flash Point: 301.5±30.1 °C
Index of Refraction: 1.593
Molar Refractivity: 123.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 2.62
ACD/KOC (pH 5.5): 15.61
ACD/LogD (pH 7.4): 3.27
ACD/BCF (pH 7.4): 131.01
ACD/KOC (pH 7.4): 781.51
Polar Surface Area: 61 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 52.0±5.0 dyne/cm
Molar Volume: 365.5±5.0 cm3

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