ChemSpider 2D Image | 1-(2-Bromophenyl)-N-[5-fluoro-2-(1-piperidinyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide | C22H23BrFN3O2

1-(2-Bromophenyl)-N-[5-fluoro-2-(1-piperidinyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide

  • Molecular FormulaC22H23BrFN3O2
  • Average mass460.339 Da
  • Monoisotopic mass459.095764 Da
  • ChemSpider ID70858159

More details:






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

1-(2-Bromophenyl)-N-[5-fluoro-2-(1-piperidinyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
1-(2-Bromophényl)-N-[5-fluoro-2-(1-pipéridinyl)phényl]-5-oxo-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
1-(2-Bromphenyl)-N-[5-fluor-2-(1-piperidinyl)phenyl]-5-oxo-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-(2-bromophenyl)-N-[5-fluoro-2-(1-piperidinyl)phenyl]-5-oxo- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 690.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 371.1±31.5 °C
Index of Refraction: 1.644
Molar Refractivity: 112.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 743.16
ACD/KOC (pH 5.5): 3845.60
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 816.39
ACD/KOC (pH 7.4): 4224.57
Polar Surface Area: 53 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 59.3±3.0 dyne/cm
Molar Volume: 311.7±3.0 cm3

Click to predict properties on the Chemicalize site






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