ChemSpider 2D Image | N-Cyclooctyl-1-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxamide | C20H29F3N4O

N-Cyclooctyl-1-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxamide

  • Molecular FormulaC20H29F3N4O
  • Average mass398.466 Da
  • Monoisotopic mass398.229340 Da
  • ChemSpider ID34982627

More details:

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

4-Piperidinecarboxamide, N-cyclooctyl-1-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]- [ACD/Index Name]
N-Cyclooctyl-1-[2-methyl-6-(trifluormethyl)-4-pyrimidinyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-Cyclooctyl-1-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-Cyclooctyl-1-[2-méthyl-6-(trifluorométhyl)-4-pyrimidinyl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
[1775444-23-9] [RN]
1775444-23-9 [RN]
BS-7409
MFCD28805890
N-cyclooctyl-1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 551.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 287.6±30.1 °C
Index of Refraction: 1.527
Molar Refractivity: 100.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 510.18
ACD/KOC (pH 5.5): 3012.67
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 513.61
ACD/KOC (pH 7.4): 3032.94
Polar Surface Area: 58 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 46.5±5.0 dyne/cm
Molar Volume: 326.5±5.0 cm3

Click to predict properties on the Chemicalize site


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