ChemSpider 2D Image | N-[2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethyl]-1-[2-(3-fluorophenyl)ethyl]-6-oxo-3-piperidinecarboxamide | C21H27FN4O2

N-[2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethyl]-1-[2-(3-fluorophenyl)ethyl]-6-oxo-3-piperidinecarboxamide

  • Molecular FormulaC21H27FN4O2
  • Average mass386.463 Da
  • Monoisotopic mass386.211792 Da
  • ChemSpider ID22229089

More details:

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

3-Piperidinecarboxamide, N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-1-[2-(3-fluorophenyl)ethyl]-6-oxo- [ACD/Index Name]
N-[2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethyl]-1-[2-(3-fluorophenyl)ethyl]-6-oxo-3-piperidinecarboxamide [ACD/IUPAC Name]
N-[2-(3,5-Diméthyl-1H-pyrazol-1-yl)éthyl]-1-[2-(3-fluorophényl)éthyl]-6-oxo-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-[2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethyl]-1-[2-(3-fluorphenyl)ethyl]-6-oxo-3-piperidincarboxamid [German] [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: 632.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.2±31.5 °C
Index of Refraction: 1.602
Molar Refractivity: 106.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 54.92
ACD/KOC (pH 5.5): 611.72
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 55.09
ACD/KOC (pH 7.4): 613.59
Polar Surface Area: 67 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 44.5±7.0 dyne/cm
Molar Volume: 311.7±7.0 cm3

Click to predict properties on the Chemicalize site


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