ChemSpider 2D Image | N-[1-(2-Fluorobenzyl)-3-piperidinyl]-3-isobutyl-N,1-dimethyl-1H-pyrazole-5-carboxamide | C22H31FN4O

N-[1-(2-Fluorobenzyl)-3-piperidinyl]-3-isobutyl-N,1-dimethyl-1H-pyrazole-5-carboxamide

  • Molecular FormulaC22H31FN4O
  • Average mass386.506 Da
  • Monoisotopic mass386.248199 Da
  • ChemSpider ID22123645

More details:

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

1H-Pyrazole-5-carboxamide, N-[1-[(2-fluorophenyl)methyl]-3-piperidinyl]-N,1-dimethyl-3-(2-methylpropyl)- [ACD/Index Name]
N-[1-(2-Fluorbenzyl)-3-piperidinyl]-3-isobutyl-N,1-dimethyl-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
N-[1-(2-Fluorobenzyl)-3-piperidinyl]-3-isobutyl-N,1-dimethyl-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
N-[1-(2-Fluorobenzyl)-3-pipéridinyl]-3-isobutyl-N,1-diméthyl-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 527.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 272.9±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 111.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.07
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 38.97
ACD/KOC (pH 7.4): 342.79
Polar Surface Area: 41 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 39.1±7.0 dyne/cm
Molar Volume: 334.8±7.0 cm3

Click to predict properties on the Chemicalize site


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