ChemSpider 2D Image | 2-{[({1-[2-(4-Fluorophenyl)ethyl]-3-piperidinyl}methyl)(methyl)amino]methyl}-3,5-dimethyl-4(1H)-pyridinone | C23H32FN3O

2-{[({1-[2-(4-Fluorophenyl)ethyl]-3-piperidinyl}methyl)(methyl)amino]methyl}-3,5-dimethyl-4(1H)-pyridinone

  • Molecular FormulaC23H32FN3O
  • Average mass385.518 Da
  • Monoisotopic mass385.252930 Da
  • ChemSpider ID30947863

More details:

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

2-{[({1-[2-(4-Fluorophenyl)ethyl]-3-piperidinyl}methyl)(methyl)amino]methyl}-3,5-dimethyl-4(1H)-pyridinone [ACD/IUPAC Name]
2-{[({1-[2-(4-Fluorophényl)éthyl]-3-pipéridinyl}méthyl)(méthyl)amino]méthyl}-3,5-diméthyl-4(1H)-pyridinone [French] [ACD/IUPAC Name]
2-{[({1-[2-(4-Fluorphenyl)ethyl]-3-piperidinyl}methyl)(methyl)amino]methyl}-3,5-dimethyl-4(1H)-pyridinon [German] [ACD/IUPAC Name]
4(1H)-Pyridinone, 2-[[[[1-[2-(4-fluorophenyl)ethyl]-3-piperidinyl]methyl]methylamino]methyl]-3,5-dimethyl- [ACD/Index Name]
2-{[({1-[2-(4-fluorophenyl)ethyl]piperidin-3-yl}methyl)(methyl)amino]methyl}-3,5-dimethylpyridin-4(1H)-one

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

Density: 1.1±0.1 g/cm3
Boiling Point: 494.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.2±3.0 kJ/mol
Flash Point: 253.1±28.7 °C
Index of Refraction: 1.536
Molar Refractivity: 111.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): -0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.67
Polar Surface Area: 36 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 356.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement