ChemSpider 2D Image | N-{2-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}cyclopentanecarboxamide | C27H36N2O5

N-{2-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}cyclopentanecarboxamide

  • Molecular FormulaC27H36N2O5
  • Average mass468.585 Da
  • Monoisotopic mass468.262421 Da
  • ChemSpider ID21665616

More details:

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

Cyclopentanecarboxamide, N-[4,5-dimethoxy-2-[(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl]phenyl]- [ACD/Index Name]
N-{2-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isochinolinyl)methyl]-4,5-dimethoxyphenyl}cyclopentancarboxamid [German] [ACD/IUPAC Name]
N-{2-[(6,7-Diméthoxy-2-méthyl-1,2,3,4-tétrahydro-1-isoquinoléinyl)méthyl]-4,5-diméthoxyphényl}cyclopentanecarboxamide [French] [ACD/IUPAC Name]
N-{2-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}cyclopentanecarboxamide [ACD/IUPAC Name]
N-{2-[(6,7-dimethoxy-2-methyl(1,2,3,4-tetrahydroisoquinolyl))methyl]-4,5-dimethoxyphenyl}cyclopentylcarboxamide
N-{2-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}cyclopentanecarboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 629.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.5±31.5 °C
Index of Refraction: 1.581
Molar Refractivity: 133.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 4.79
ACD/KOC (pH 5.5): 25.42
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 231.92
ACD/KOC (pH 7.4): 1230.95
Polar Surface Area: 69 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 399.5±3.0 cm3

Click to predict properties on the Chemicalize site


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