ChemSpider 2D Image | 1-[1-(2-Methylbenzyl)-4-piperidinyl]-N-[(2-methyl-1H-imidazol-4-yl)methyl]-N-(3-pyridinylmethyl)methanamine | C25H33N5

1-[1-(2-Methylbenzyl)-4-piperidinyl]-N-[(2-methyl-1H-imidazol-4-yl)methyl]-N-(3-pyridinylmethyl)methanamine

  • Molecular FormulaC25H33N5
  • Average mass403.563 Da
  • Monoisotopic mass403.273590 Da
  • ChemSpider ID23072962

More details:

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

1-[1-(2-Methylbenzyl)-4-piperidinyl]-N-[(2-methyl-1H-imidazol-4-yl)methyl]-N-(3-pyridinylmethyl)methanamin [German] [ACD/IUPAC Name]
1-[1-(2-Methylbenzyl)-4-piperidinyl]-N-[(2-methyl-1H-imidazol-4-yl)methyl]-N-(3-pyridinylmethyl)methanamine [ACD/IUPAC Name]
1-[1-(2-Méthylbenzyl)-4-pipéridinyl]-N-[(2-méthyl-1H-imidazol-4-yl)méthyl]-N-(3-pyridinylméthyl)méthanamine [French] [ACD/IUPAC Name]
3-Pyridinemethanamine, N-[(2-methyl-1H-imidazol-4-yl)methyl]-N-[[1-[(2-methylphenyl)methyl]-4-piperidinyl]methyl]- [ACD/Index Name]
[(2-METHYL-1H-IMIDAZOL-4-YL)METHYL]({1-[(2-METHYLPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)(PYRIDIN-3-YLMETHYL)AMINE
[(2-METHYL-1H-IMIDAZOL-4-YL)METHYL]({1-[(2-METHYLPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)[(PYRIDIN-3-YL)METHYL]AMINE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 590.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 311.1±28.7 °C
Index of Refraction: 1.606
Molar Refractivity: 122.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 1.78
ACD/KOC (pH 7.4): 15.30
Polar Surface Area: 48 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 53.4±3.0 dyne/cm
Molar Volume: 355.9±3.0 cm3

Click to predict properties on the Chemicalize site


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