ChemSpider 2D Image | N-Ethyl-N-({1-[2-(3-fluorophenyl)ethyl]-3-piperidinyl}methyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide | C22H31FN4O

N-Ethyl-N-({1-[2-(3-fluorophenyl)ethyl]-3-piperidinyl}methyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide

  • Molecular FormulaC22H31FN4O
  • Average mass386.506 Da
  • Monoisotopic mass386.248199 Da
  • ChemSpider ID22209276

More details:

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

1H-Pyrazole-3-carboxamide, N-ethyl-N-[[1-[2-(3-fluorophenyl)ethyl]-3-piperidinyl]methyl]-1,5-dimethyl- [ACD/Index Name]
N-Ethyl-N-({1-[2-(3-fluorophenyl)ethyl]-3-piperidinyl}methyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
N-Éthyl-N-({1-[2-(3-fluorophényl)éthyl]-3-pipéridinyl}méthyl)-1,5-diméthyl-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
N-Ethyl-N-({1-[2-(3-fluorphenyl)ethyl]-3-piperidinyl}methyl)-1,5-dimethyl-1H-pyrazol-3-carboxamid [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: 534.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 277.2±28.7 °C
Index of Refraction: 1.578
Molar Refractivity: 111.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.45
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 5.80
ACD/KOC (pH 7.4): 55.24
Polar Surface Area: 41 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 335.7±7.0 cm3

Click to predict properties on the Chemicalize site


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