ChemSpider 2D Image | 1-(4-Chloro-3-fluorophenyl)-5-oxo-N-(3-pyridinylmethyl)-3-pyrrolidinecarboxamide | C17H15ClFN3O2

1-(4-Chloro-3-fluorophenyl)-5-oxo-N-(3-pyridinylmethyl)-3-pyrrolidinecarboxamide

  • Molecular FormulaC17H15ClFN3O2
  • Average mass347.771 Da
  • Monoisotopic mass347.083679 Da
  • ChemSpider ID21804729

More details:

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

1-(4-Chlor-3-fluorphenyl)-5-oxo-N-(3-pyridinylmethyl)-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
1-(4-Chloro-3-fluorophenyl)-5-oxo-N-(3-pyridinylmethyl)-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
1-(4-Chloro-3-fluorophényl)-5-oxo-N-(3-pyridinylméthyl)-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-(4-chloro-3-fluorophenyl)-5-oxo-N-(3-pyridinylmethyl)- [ACD/Index Name]
1-(4-chloro-3-fluorophenyl)-5-oxo-N-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide
1-(4-Chloro-3-fluoro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid (pyridin-3-ylmethyl)-amide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 685.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 368.4±31.5 °C
Index of Refraction: 1.610
Molar Refractivity: 86.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 9.10
ACD/KOC (pH 5.5): 163.90
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 10.14
ACD/KOC (pH 7.4): 182.60
Polar Surface Area: 62 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 250.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement