ChemSpider 2D Image | 1-Cyclopropyl-5-oxo-N-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-3-pyrrolidinecarboxamide | C22H29F3N4O2

1-Cyclopropyl-5-oxo-N-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-3-pyrrolidinecarboxamide

  • Molecular FormulaC22H29F3N4O2
  • Average mass438.487 Da
  • Monoisotopic mass438.224274 Da
  • ChemSpider ID29992425

More details:

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

1-Cyclopropyl-5-oxo-N-(3-{4-[3-(trifluormethyl)phenyl]-1-piperazinyl}propyl)-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
1-Cyclopropyl-5-oxo-N-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}propyl)-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
1-Cyclopropyl-5-oxo-N-(3-{4-[3-(trifluorométhyl)phényl]-1-pipérazinyl}propyl)-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-cyclopropyl-5-oxo-N-[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 642.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.1±31.5 °C
Index of Refraction: 1.558
Molar Refractivity: 109.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 0.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.46
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 22.51
ACD/KOC (pH 7.4): 292.78
Polar Surface Area: 56 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 338.5±3.0 cm3

Click to predict properties on the Chemicalize site


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