ChemSpider 2D Image | 1-Butyl-2-(2-methoxyphenyl)-6-oxo-N-[4-(1-pyrrolidinylmethyl)benzyl]-3-piperidinecarboxamide | C29H39N3O3

1-Butyl-2-(2-methoxyphenyl)-6-oxo-N-[4-(1-pyrrolidinylmethyl)benzyl]-3-piperidinecarboxamide

  • Molecular FormulaC29H39N3O3
  • Average mass477.638 Da
  • Monoisotopic mass477.299133 Da
  • ChemSpider ID24141694

More details:

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

1-Butyl-2-(2-methoxyphenyl)-6-oxo-N-[4-(1-pyrrolidinylmethyl)benzyl]-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-Butyl-2-(2-methoxyphenyl)-6-oxo-N-[4-(1-pyrrolidinylmethyl)benzyl]-3-piperidinecarboxamide [ACD/IUPAC Name]
1-Butyl-2-(2-méthoxyphényl)-6-oxo-N-[4-(1-pyrrolidinylméthyl)benzyl]-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]- [ACD/Index Name]
1-BUTYL-2-(2-METHOXYPHENYL)-6-OXO-N-({4-[(PYRROLIDIN-1-YL)METHYL]PHENYL}METHYL)PIPERIDINE-3-CARBOXAMIDE
1-BUTYL-2-(2-METHOXYPHENYL)-6-OXO-N-{[4-(PYRROLIDIN-1-YLMETHYL)PHENYL]METHYL}PIPERIDINE-3-CARBOXAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 684.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.4±3.0 kJ/mol
Flash Point: 367.6±31.5 °C
Index of Refraction: 1.571
Molar Refractivity: 138.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.57
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 6.82
ACD/KOC (pH 7.4): 32.28
Polar Surface Area: 62 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 422.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement