ChemSpider 2D Image | N-{3-Methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-5-yl}-1-(1-pyrrolidinylcarbonyl)-4-piperidinecarboxamide | C21H25F3N6O2

N-{3-Methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-5-yl}-1-(1-pyrrolidinylcarbonyl)-4-piperidinecarboxamide

  • Molecular FormulaC21H25F3N6O2
  • Average mass450.457 Da
  • Monoisotopic mass450.199097 Da
  • ChemSpider ID31808390

More details:

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

4-Piperidinecarboxamide, N-[3-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-5-yl]-1-(1-pyrrolidinylcarbonyl)- [ACD/Index Name]
N-{3-Methyl-1-[5-(trifluormethyl)-2-pyridinyl]-1H-pyrazol-5-yl}-1-(1-pyrrolidinylcarbonyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-{3-Methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-1H-pyrazol-5-yl}-1-(1-pyrrolidinylcarbonyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
N-{3-Méthyl-1-[5-(trifluorométhyl)-2-pyridinyl]-1H-pyrazol-5-yl}-1-(1-pyrrolidinylcarbonyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC 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: 613.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 325.0±31.5 °C
Index of Refraction: 1.640
Molar Refractivity: 111.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 124.48
ACD/KOC (pH 5.5): 1099.73
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 124.48
ACD/KOC (pH 7.4): 1099.74
Polar Surface Area: 83 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 310.6±7.0 cm3

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