ChemSpider 2D Image | 2-[4-Fluoro-3-(trifluoromethyl)phenyl]-N-{[2-(4-methyl-1-piperidinyl)-6-(trifluoromethyl)-3-pyridinyl]methyl}propanamide | C23H24F7N3O

2-[4-Fluoro-3-(trifluoromethyl)phenyl]-N-{[2-(4-methyl-1-piperidinyl)-6-(trifluoromethyl)-3-pyridinyl]methyl}propanamide

  • Molecular FormulaC23H24F7N3O
  • Average mass491.445 Da
  • Monoisotopic mass491.180756 Da
  • ChemSpider ID129192716

More details:

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

2-[4-Fluor-3-(trifluormethyl)phenyl]-N-{[2-(4-methyl-1-piperidinyl)-6-(trifluormethyl)-3-pyridinyl]methyl}propanamid [German] [ACD/IUPAC Name]
2-[4-Fluoro-3-(trifluoromethyl)phenyl]-N-{[2-(4-methyl-1-piperidinyl)-6-(trifluoromethyl)-3-pyridinyl]methyl}propanamide [ACD/IUPAC Name]
2-[4-Fluoro-3-(trifluorométhyl)phényl]-N-{[2-(4-méthyl-1-pipéridinyl)-6-(trifluorométhyl)-3-pyridinyl]méthyl}propanamide [French] [ACD/IUPAC Name]
Benzeneacetamide, 4-fluoro-α-methyl-N-[[2-(4-methyl-1-piperidinyl)-6-(trifluoromethyl)-3-pyridinyl]methyl]-3-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 563.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 294.6±30.1 °C
Index of Refraction: 1.496
Molar Refractivity: 110.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 5.38
ACD/BCF (pH 5.5): 7166.41
ACD/KOC (pH 5.5): 19971.92
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7212.20
ACD/KOC (pH 7.4): 20099.53
Polar Surface Area: 45 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 379.4±3.0 cm3

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