ChemSpider 2D Image | 1-[1-(1,3-Benzodioxol-5-ylmethyl)-4-piperidinyl]-N-(2-methoxyethyl)-2-phenyl-N-(3-pyridinylmethyl)ethanamine | C30H37N3O3

1-[1-(1,3-Benzodioxol-5-ylmethyl)-4-piperidinyl]-N-(2-methoxyethyl)-2-phenyl-N-(3-pyridinylmethyl)ethanamine

  • Molecular FormulaC30H37N3O3
  • Average mass487.633 Da
  • Monoisotopic mass487.283478 Da
  • ChemSpider ID22243358

More details:

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

1-[1-(1,3-Benzodioxol-5-ylmethyl)-4-piperidinyl]-N-(2-methoxyethyl)-2-phenyl-N-(3-pyridinylmethyl)ethanamin [German] [ACD/IUPAC Name]
1-[1-(1,3-Benzodioxol-5-ylmethyl)-4-piperidinyl]-N-(2-methoxyethyl)-2-phenyl-N-(3-pyridinylmethyl)ethanamine [ACD/IUPAC Name]
1-[1-(1,3-Benzodioxol-5-ylméthyl)-4-pipéridinyl]-N-(2-méthoxyéthyl)-2-phényl-N-(3-pyridinylméthyl)éthanamine [French] [ACD/IUPAC Name]
3-Pyridinemethanamine, N-[1-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]-2-phenylethyl]-N-(2-methoxyethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 609.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 322.2±31.5 °C
Index of Refraction: 1.598
Molar Refractivity: 142.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 42.89
ACD/KOC (pH 7.4): 215.64
Polar Surface Area: 47 Å2
Polarizability: 56.4±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 416.9±3.0 cm3

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