ChemSpider 2D Image | 3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-{2-[4-methyl-6-(methylamino)-2-pyridinyl]ethyl}benzonitrile | C24H27N5

3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-{2-[4-methyl-6-(methylamino)-2-pyridinyl]ethyl}benzonitrile

  • Molecular FormulaC24H27N5
  • Average mass385.505 Da
  • Monoisotopic mass385.226654 Da
  • ChemSpider ID35033893

More details:

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

3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-{2-[4-methyl-6-(methylamino)-2-pyridinyl]ethyl}benzonitril [German] [ACD/IUPAC Name]
3-[2-(6-Amino-4-methyl-2-pyridinyl)ethyl]-5-{2-[4-methyl-6-(methylamino)-2-pyridinyl]ethyl}benzonitrile [ACD/IUPAC Name]
3-[2-(6-Amino-4-méthyl-2-pyridinyl)éthyl]-5-{2-[4-méthyl-6-(méthylamino)-2-pyridinyl]éthyl}benzonitrile [French] [ACD/IUPAC Name]
3-[2-(6-Amino-4-Methylpyridin-2-Yl)ethyl]-5-{2-[4-Methyl-6-(Methylamino)pyridin-2-Yl]ethyl}benzonitrile
Benzonitrile, 3-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-5-[2-[4-methyl-6-(methylamino)-2-pyridinyl]ethyl]- [ACD/Index Name]
IVU

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

Density: 1.2±0.1 g/cm3
Boiling Point: 571.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 299.4±30.1 °C
Index of Refraction: 1.625
Molar Refractivity: 116.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.79
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 1.79
ACD/KOC (pH 5.5): 6.28
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 838.02
ACD/KOC (pH 7.4): 2941.67
Polar Surface Area: 88 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 61.8±5.0 dyne/cm
Molar Volume: 327.9±5.0 cm3

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