ChemSpider 2D Image | N-{1-[1-(3,3-Dimethylbutanoyl)-4-piperidinyl]-1H-pyrazol-5-yl}-3-fluorobenzamide | C21H27FN4O2

N-{1-[1-(3,3-Dimethylbutanoyl)-4-piperidinyl]-1H-pyrazol-5-yl}-3-fluorobenzamide

  • Molecular FormulaC21H27FN4O2
  • Average mass386.463 Da
  • Monoisotopic mass386.211792 Da
  • ChemSpider ID22197665

More details:

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

Benzamide, N-[1-[1-(3,3-dimethyl-1-oxobutyl)-4-piperidinyl]-1H-pyrazol-5-yl]-3-fluoro- [ACD/Index Name]
N-{1-[1-(3,3-Dimethylbutanoyl)-4-piperidinyl]-1H-pyrazol-5-yl}-3-fluorbenzamid [German] [ACD/IUPAC Name]
N-{1-[1-(3,3-Dimethylbutanoyl)-4-piperidinyl]-1H-pyrazol-5-yl}-3-fluorobenzamide [ACD/IUPAC Name]
N-{1-[1-(3,3-Diméthylbutanoyl)-4-pipéridinyl]-1H-pyrazol-5-yl}-3-fluorobenzamide [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: 507.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 260.9±30.1 °C
Index of Refraction: 1.594
Molar Refractivity: 107.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 101.34
ACD/KOC (pH 5.5): 949.04
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 101.39
ACD/KOC (pH 7.4): 949.49
Polar Surface Area: 67 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 316.2±7.0 cm3

Click to predict properties on the Chemicalize site


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