ChemSpider 2D Image | (1-Ethyl-3-isobutyl-1H-pyrazol-5-yl){3-[2-(2-fluorophenyl)ethyl]-1-piperidinyl}methanone | C23H32FN3O

(1-Ethyl-3-isobutyl-1H-pyrazol-5-yl){3-[2-(2-fluorophenyl)ethyl]-1-piperidinyl}methanone

  • Molecular FormulaC23H32FN3O
  • Average mass385.518 Da
  • Monoisotopic mass385.252930 Da
  • ChemSpider ID29611433

More details:

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

(1-Ethyl-3-isobutyl-1H-pyrazol-5-yl){3-[2-(2-fluorophenyl)ethyl]-1-piperidinyl}methanone [ACD/IUPAC Name]
(1-Éthyl-3-isobutyl-1H-pyrazol-5-yl){3-[2-(2-fluorophényl)éthyl]-1-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
(1-Ethyl-3-isobutyl-1H-pyrazol-5-yl){3-[2-(2-fluorphenyl)ethyl]-1-piperidinyl}methanon [German] [ACD/IUPAC Name]
Methanone, [1-ethyl-3-(2-methylpropyl)-1H-pyrazol-5-yl][3-[2-(2-fluorophenyl)ethyl]-1-piperidinyl]- [ACD/Index Name]
1-[(1-ethyl-3-isobutyl-1H-pyrazol-5-yl)carbonyl]-3-[2-(2-fluorophenyl)ethyl]piperidine
1-[1-ETHYL-3-(2-METHYLPROPYL)-1H-PYRAZOLE-5-CARBONYL]-3-[2-(2-FLUOROPHENYL)ETHYL]PIPERIDINE
1-[2-ETHYL-5-(2-METHYLPROPYL)PYRAZOLE-3-CARBONYL]-3-[2-(2-FLUOROPHENYL)ETHYL]PIPERIDINE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 530.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 274.7±27.3 °C
Index of Refraction: 1.571
Molar Refractivity: 112.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 1939.66
ACD/KOC (pH 5.5): 7851.11
ACD/LogD (pH 7.4): 4.63
ACD/BCF (pH 7.4): 1939.95
ACD/KOC (pH 7.4): 7852.31
Polar Surface Area: 38 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 38.5±7.0 dyne/cm
Molar Volume: 341.0±7.0 cm3

Click to predict properties on the Chemicalize site


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