ChemSpider 2D Image | N-Cyclopentyl-2-methyl-N-({1-[2-(2-methylphenyl)ethyl]-4-piperidinyl}methyl)nicotinamide | C27H37N3O

N-Cyclopentyl-2-methyl-N-({1-[2-(2-methylphenyl)ethyl]-4-piperidinyl}methyl)nicotinamide

  • Molecular FormulaC27H37N3O
  • Average mass419.602 Da
  • Monoisotopic mass419.293671 Da
  • ChemSpider ID23066775

More details:

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

3-Pyridinecarboxamide, N-cyclopentyl-2-methyl-N-[[1-[2-(2-methylphenyl)ethyl]-4-piperidinyl]methyl]- [ACD/Index Name]
N-Cyclopentyl-2-methyl-N-({1-[2-(2-methylphenyl)ethyl]-4-piperidinyl}methyl)nicotinamid [German] [ACD/IUPAC Name]
N-Cyclopentyl-2-methyl-N-({1-[2-(2-methylphenyl)ethyl]-4-piperidinyl}methyl)nicotinamide [ACD/IUPAC Name]
N-Cyclopentyl-2-méthyl-N-({1-[2-(2-méthylphényl)éthyl]-4-pipéridinyl}méthyl)nicotinamide [French] [ACD/IUPAC Name]
N-CYCLOPENTYL-2-METHYL-N-({1-[2-(2-METHYLPHENYL)ETHYL]PIPERIDIN-4-YL}METHYL)PYRIDINE-3-CARBOXAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 581.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 305.2±28.7 °C
Index of Refraction: 1.591
Molar Refractivity: 127.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 2.45
ACD/KOC (pH 5.5): 9.68
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 80.36
ACD/KOC (pH 7.4): 317.92
Polar Surface Area: 36 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 51.2±5.0 dyne/cm
Molar Volume: 375.9±5.0 cm3

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