ChemSpider 2D Image | N-(4-Fluoro-2-methylphenyl)-3-{1-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-piperidinyl}propanamide | C20H27FN4O

N-(4-Fluoro-2-methylphenyl)-3-{1-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-piperidinyl}propanamide

  • Molecular FormulaC20H27FN4O
  • Average mass358.453 Da
  • Monoisotopic mass358.216888 Da
  • ChemSpider ID22147973

More details:

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

3-Piperidinepropanamide, N-(4-fluoro-2-methylphenyl)-1-[(1-methyl-1H-pyrazol-4-yl)methyl]- [ACD/Index Name]
N-(4-Fluor-2-methylphenyl)-3-{1-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-piperidinyl}propanamid [German] [ACD/IUPAC Name]
N-(4-Fluoro-2-methylphenyl)-3-{1-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-piperidinyl}propanamide [ACD/IUPAC Name]
N-(4-Fluoro-2-méthylphényl)-3-{1-[(1-méthyl-1H-pyrazol-4-yl)méthyl]-3-pipéridinyl}propanamide [French] [ACD/IUPAC Name]
N-(4-FLUORO-2-METHYLPHENYL)-3-{1-[(1-METHYL-1H-PYRAZOL-4-YL)METHYL]PIPERIDIN-3-YL}PROPANAMIDE
N-(4-FLUORO-2-METHYLPHENYL)-3-{1-[(1-METHYLPYRAZOL-4-YL)METHYL]PIPERIDIN-3-YL}PROPANAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 522.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 269.6±28.7 °C
Index of Refraction: 1.595
Molar Refractivity: 101.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.04
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 8.66
ACD/KOC (pH 7.4): 68.58
Polar Surface Area: 50 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 42.3±7.0 dyne/cm
Molar Volume: 298.4±7.0 cm3

Click to predict properties on the Chemicalize site


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