ChemSpider 2D Image | 2-Methyl-N-{[1-(2-methylbenzyl)-4-piperidinyl]methyl}-N-(3-pyridinylmethyl)nicotinamide | C27H32N4O

2-Methyl-N-{[1-(2-methylbenzyl)-4-piperidinyl]methyl}-N-(3-pyridinylmethyl)nicotinamide

  • Molecular FormulaC27H32N4O
  • Average mass428.569 Da
  • Monoisotopic mass428.257599 Da
  • ChemSpider ID22148464

More details:

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

2-Methyl-N-{[1-(2-methylbenzyl)-4-piperidinyl]methyl}-N-(3-pyridinylmethyl)nicotinamid [German] [ACD/IUPAC Name]
2-Methyl-N-{[1-(2-methylbenzyl)-4-piperidinyl]methyl}-N-(3-pyridinylmethyl)nicotinamide [ACD/IUPAC Name]
2-Méthyl-N-{[1-(2-méthylbenzyl)-4-pipéridinyl]méthyl}-N-(3-pyridinylméthyl)nicotinamide [French] [ACD/IUPAC Name]
3-Pyridinecarboxamide, 2-methyl-N-[[1-[(2-methylphenyl)methyl]-4-piperidinyl]methyl]-N-(3-pyridinylmethyl)- [ACD/Index Name]
2-METHYL-N-({1-[(2-METHYLPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)-N-(PYRIDIN-3-YLMETHYL)PYRIDINE-3-CARBOXAMIDE
2-METHYL-N-({1-[(2-METHYLPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)-N-[(PYRIDIN-3-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: 617.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 327.5±31.5 °C
Index of Refraction: 1.600
Molar Refractivity: 128.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.90
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 11.63
ACD/KOC (pH 7.4): 98.00
Polar Surface Area: 49 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 376.3±3.0 cm3

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