ChemSpider 2D Image | N-(3-Hydroxy-2,2-dimethylpropyl)-2-{3-oxo-1-[3-(trifluoromethyl)benzyl]-2-piperazinyl}acetamide | C19H26F3N3O3

N-(3-Hydroxy-2,2-dimethylpropyl)-2-{3-oxo-1-[3-(trifluoromethyl)benzyl]-2-piperazinyl}acetamide

  • Molecular FormulaC19H26F3N3O3
  • Average mass401.423 Da
  • Monoisotopic mass401.192627 Da
  • ChemSpider ID22206992

More details:

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

2-Piperazineacetamide, N-(3-hydroxy-2,2-dimethylpropyl)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
N-(3-Hydroxy-2,2-dimethylpropyl)-2-{3-oxo-1-[3-(trifluormethyl)benzyl]-2-piperazinyl}acetamid [German] [ACD/IUPAC Name]
N-(3-Hydroxy-2,2-dimethylpropyl)-2-{3-oxo-1-[3-(trifluoromethyl)benzyl]-2-piperazinyl}acetamide [ACD/IUPAC Name]
N-(3-Hydroxy-2,2-diméthylpropyl)-2-{3-oxo-1-[3-(trifluorométhyl)benzyl]-2-pipérazinyl}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: 596.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 314.8±30.1 °C
Index of Refraction: 1.509
Molar Refractivity: 97.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.31
ACD/LogD (pH 5.5): 0.77
ACD/BCF (pH 5.5): 1.93
ACD/KOC (pH 5.5): 45.85
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 3.76
ACD/KOC (pH 7.4): 89.52
Polar Surface Area: 82 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 325.5±3.0 cm3

Click to predict properties on the Chemicalize site


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