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

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

  • Molecular FormulaC21H27FN4O2
  • Average mass386.463 Da
  • Monoisotopic mass386.211792 Da
  • ChemSpider ID22249669

More details:

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

3-Piperidinecarboxamide, N-ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]- [ACD/Index Name]
N-Ethyl-1-[2-(3-fluorophenyl)ethyl]-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]-3-piperidinecarboxamide [ACD/IUPAC Name]
N-Éthyl-1-[2-(3-fluorophényl)éthyl]-6-oxo-N-[2-(1H-pyrazol-1-yl)éthyl]-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-Ethyl-1-[2-(3-fluorphenyl)ethyl]-6-oxo-N-[2-(1H-pyrazol-1-yl)ethyl]-3-piperidincarboxamid [German] [ACD/IUPAC Name]
N-ETHYL-1-[2-(3-FLUOROPHENYL)ETHYL]-6-OXO-N-[2-(1H-PYRAZOL-1-YL)ETHYL]PIPERIDINE-3-CARBOXAMIDE
N-ETHYL-1-[2-(3-FLUOROPHENYL)ETHYL]-6-OXO-N-[2-(PYRAZOL-1-YL)ETHYL]PIPERIDINE-3-CARBOXAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 594.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 313.2±30.1 °C
Index of Refraction: 1.593
Molar Refractivity: 108.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.04
ACD/KOC (pH 5.5): 406.87
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.05
ACD/KOC (pH 7.4): 406.99
Polar Surface Area: 58 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 45.3±7.0 dyne/cm
Molar Volume: 318.7±7.0 cm3

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