ChemSpider 2D Image | Ethyl N-[(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)carbonyl]glycinate | C21H33N3O5

Ethyl N-[(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)carbonyl]glycinate

  • Molecular FormulaC21H33N3O5
  • Average mass407.504 Da
  • Monoisotopic mass407.242035 Da
  • ChemSpider ID22191251

More details:

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

Ethyl N-[(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)carbonyl]glycinate [ACD/IUPAC Name]
Ethyl-N-[(3-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)carbonyl]glycinat [German] [ACD/IUPAC Name]
Glycine, N-[[3-[[2-(3,4-dimethoxyphenyl)ethyl]methylamino]-1-piperidinyl]carbonyl]-, ethyl ester [ACD/Index Name]
N-[(3-{[2-(3,4-Diméthoxyphényl)éthyl](méthyl)amino}-1-pipéridinyl)carbonyl]glycinate d'éthyle [French] [ACD/IUPAC Name]
ethyl N-({3-[[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino]-1-piperidinyl}carbonyl)glycinate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 591.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 311.2±30.1 °C
Index of Refraction: 1.549
Molar Refractivity: 111.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.59
ACD/LogD (pH 7.4): 1.52
ACD/BCF (pH 7.4): 5.89
ACD/KOC (pH 7.4): 80.76
Polar Surface Area: 80 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 48.8±5.0 dyne/cm
Molar Volume: 348.7±5.0 cm3

Click to predict properties on the Chemicalize site


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