ChemSpider 2D Image | 1-(1-Cyclopentyl-4-piperidinyl)-N-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]-N-(3-pyridinylmethyl)methanamine | C28H38N4O

1-(1-Cyclopentyl-4-piperidinyl)-N-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]-N-(3-pyridinylmethyl)methanamine

  • Molecular FormulaC28H38N4O
  • Average mass446.628 Da
  • Monoisotopic mass446.304565 Da
  • ChemSpider ID22133163

More details:






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

1-(1-Cyclopentyl-4-piperidinyl)-N-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]-N-(3-pyridinylmethyl)methanamin [German] [ACD/IUPAC Name]
1-(1-Cyclopentyl-4-piperidinyl)-N-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]-N-(3-pyridinylmethyl)methanamine [ACD/IUPAC Name]
1-(1-Cyclopentyl-4-pipéridinyl)-N-[(5-méthoxy-3-méthyl-1H-indol-2-yl)méthyl]-N-(3-pyridinylméthyl)méthanamine [French] [ACD/IUPAC Name]
1H-Indole-2-methanamine, N-[(1-cyclopentyl-4-piperidinyl)methyl]-5-methoxy-3-methyl-N-(3-pyridinylmethyl)- [ACD/Index Name]
[(1-CYCLOPENTYLPIPERIDIN-4-YL)METHYL][(5-METHOXY-3-METHYL-1H-INDOL-2-YL)METHYL](PYRIDIN-3-YLMETHYL)AMINE
[(1-CYCLOPENTYLPIPERIDIN-4-YL)METHYL][(5-METHOXY-3-METHYL-1H-INDOL-2-YL)METHYL][(PYRIDIN-3-YL)METHYL]AMINE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 603.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.8±3.0 kJ/mol
Flash Point: 318.7±30.1 °C
Index of Refraction: 1.619
Molar Refractivity: 136.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.17
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 10.24
ACD/KOC (pH 7.4): 33.80
Polar Surface Area: 44 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 388.6±3.0 cm3

Click to predict properties on the Chemicalize site






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