ChemSpider 2D Image | 2-(1H-Imidazol-1-yl)-N-methyl-N-[(1-{2-[3-(trifluoromethyl)phenyl]ethyl}-3-piperidinyl)methyl]acetamide | C21H27F3N4O

2-(1H-Imidazol-1-yl)-N-methyl-N-[(1-{2-[3-(trifluoromethyl)phenyl]ethyl}-3-piperidinyl)methyl]acetamide

  • Molecular FormulaC21H27F3N4O
  • Average mass408.461 Da
  • Monoisotopic mass408.213684 Da
  • ChemSpider ID22245230

More details:

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

1H-Imidazole-1-acetamide, N-methyl-N-[[1-[2-[3-(trifluoromethyl)phenyl]ethyl]-3-piperidinyl]methyl]- [ACD/Index Name]
2-(1H-Imidazol-1-yl)-N-methyl-N-[(1-{2-[3-(trifluormethyl)phenyl]ethyl}-3-piperidinyl)methyl]acetamid [German] [ACD/IUPAC Name]
2-(1H-Imidazol-1-yl)-N-methyl-N-[(1-{2-[3-(trifluoromethyl)phenyl]ethyl}-3-piperidinyl)methyl]acetamide [ACD/IUPAC Name]
2-(1H-Imidazol-1-yl)-N-méthyl-N-[(1-{2-[3-(trifluorométhyl)phényl]éthyl}-3-pipéridinyl)méthyl]acétamide [French] [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: 526.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.1±3.0 kJ/mol
Flash Point: 272.5±30.1 °C
Index of Refraction: 1.559
Molar Refractivity: 107.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 4.27
ACD/KOC (pH 7.4): 41.88
Polar Surface Area: 41 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 332.5±7.0 cm3

Click to predict properties on the Chemicalize site


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