ChemSpider 2D Image | 1-Isobutyl-4-oxo-5-(1-piperidinylcarbonyl)-N-[2,2,2-trifluoro-1-(2-pyridinyl)ethyl]-1,4-dihydro-3-pyridinecarboxamide | C23H27F3N4O3

1-Isobutyl-4-oxo-5-(1-piperidinylcarbonyl)-N-[2,2,2-trifluoro-1-(2-pyridinyl)ethyl]-1,4-dihydro-3-pyridinecarboxamide

  • Molecular FormulaC23H27F3N4O3
  • Average mass464.481 Da
  • Monoisotopic mass464.203522 Da
  • ChemSpider ID22233027

More details:

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

1-Isobutyl-4-oxo-5-(1-piperidinylcarbonyl)-N-[2,2,2-trifluor-1-(2-pyridinyl)ethyl]-1,4-dihydro-3-pyridincarboxamid [German] [ACD/IUPAC Name]
1-Isobutyl-4-oxo-5-(1-piperidinylcarbonyl)-N-[2,2,2-trifluoro-1-(2-pyridinyl)ethyl]-1,4-dihydro-3-pyridinecarboxamide [ACD/IUPAC Name]
1-Isobutyl-4-oxo-5-(1-pipéridinylcarbonyl)-N-[2,2,2-trifluoro-1-(2-pyridinyl)éthyl]-1,4-dihydro-3-pyridinecarboxamide [French] [ACD/IUPAC Name]
3-Pyridinecarboxamide, 1,4-dihydro-1-(2-methylpropyl)-4-oxo-5-(1-piperidinylcarbonyl)-N-[2,2,2-trifluoro-1-(2-pyridinyl)ethyl]- [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: 622.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.3±3.0 kJ/mol
Flash Point: 330.5±31.5 °C
Index of Refraction: 1.547
Molar Refractivity: 114.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.35
ACD/KOC (pH 5.5): 130.51
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 6.09
ACD/KOC (pH 7.4): 125.32
Polar Surface Area: 83 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 360.0±3.0 cm3

Click to predict properties on the Chemicalize site


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