ChemSpider 2D Image | 1-(3,5-Dimethoxybenzyl)-6-phenyl-N-[3-(trifluoromethyl)benzyl]-3-piperidinecarboxamide | C29H31F3N2O3

1-(3,5-Dimethoxybenzyl)-6-phenyl-N-[3-(trifluoromethyl)benzyl]-3-piperidinecarboxamide

  • Molecular FormulaC29H31F3N2O3
  • Average mass512.563 Da
  • Monoisotopic mass512.228699 Da
  • ChemSpider ID22703742

More details:

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

1-(3,5-Dimethoxybenzyl)-6-phenyl-N-[3-(trifluormethyl)benzyl]-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-(3,5-Dimethoxybenzyl)-6-phenyl-N-[3-(trifluoromethyl)benzyl]-3-piperidinecarboxamide [ACD/IUPAC Name]
1-(3,5-Diméthoxybenzyl)-6-phényl-N-[3-(trifluorométhyl)benzyl]-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-[(3,5-dimethoxyphenyl)methyl]-6-phenyl-N-[[3-(trifluoromethyl)phenyl]methyl]- [ACD/Index 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: 637.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 339.3±31.5 °C
Index of Refraction: 1.557
Molar Refractivity: 135.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.69
ACD/LogD (pH 5.5): 3.59
ACD/BCF (pH 5.5): 120.45
ACD/KOC (pH 5.5): 344.44
ACD/LogD (pH 7.4): 5.09
ACD/BCF (pH 7.4): 3862.46
ACD/KOC (pH 7.4): 11044.83
Polar Surface Area: 51 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 422.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement