ChemSpider 2D Image | N-{[1-(2-Methylbenzyl)-4-piperidinyl]methyl}-2-(4-pyridinyl)-N-(3-pyridinylmethyl)acetamide | C27H32N4O

N-{[1-(2-Methylbenzyl)-4-piperidinyl]methyl}-2-(4-pyridinyl)-N-(3-pyridinylmethyl)acetamide

  • Molecular FormulaC27H32N4O
  • Average mass428.569 Da
  • Monoisotopic mass428.257599 Da
  • ChemSpider ID22226007

More details:

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

4-Pyridineacetamide, N-[[1-[(2-methylphenyl)methyl]-4-piperidinyl]methyl]-N-(3-pyridinylmethyl)- [ACD/Index Name]
N-{[1-(2-Methylbenzyl)-4-piperidinyl]methyl}-2-(4-pyridinyl)-N-(3-pyridinylmethyl)acetamid [German] [ACD/IUPAC Name]
N-{[1-(2-Methylbenzyl)-4-piperidinyl]methyl}-2-(4-pyridinyl)-N-(3-pyridinylmethyl)acetamide [ACD/IUPAC Name]
N-{[1-(2-Méthylbenzyl)-4-pipéridinyl]méthyl}-2-(4-pyridinyl)-N-(3-pyridinylméthyl)acétamide [French] [ACD/IUPAC Name]
N-({1-[(2-METHYLPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)-N-(PYRIDIN-3-YLMETHYL)-2-(PYRIDIN-4-YL)ACETAMIDE
N-({1-[(2-METHYLPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)-N-[(PYRIDIN-3-YL)METHYL]-2-(PYRIDIN-4-YL)ACETAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 624.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 331.3±31.5 °C
Index of Refraction: 1.599
Molar Refractivity: 128.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.80
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 18.17
ACD/KOC (pH 7.4): 138.02
Polar Surface Area: 49 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 374.9±3.0 cm3

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