ChemSpider 2D Image | 1-(3-{[2-(3,4-Dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)-3-(1,2-oxazinan-2-yl)-1-propanone | C23H37N3O4

1-(3-{[2-(3,4-Dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)-3-(1,2-oxazinan-2-yl)-1-propanone

  • Molecular FormulaC23H37N3O4
  • Average mass419.558 Da
  • Monoisotopic mass419.278412 Da
  • ChemSpider ID22198483

More details:

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

1-(3-{[2-(3,4-Dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)-3-(1,2-oxazinan-2-yl)-1-propanon [German] [ACD/IUPAC Name]
1-(3-{[2-(3,4-Dimethoxyphenyl)ethyl](methyl)amino}-1-piperidinyl)-3-(1,2-oxazinan-2-yl)-1-propanone [ACD/IUPAC Name]
1-(3-{[2-(3,4-Diméthoxyphényl)éthyl](méthyl)amino}-1-pipéridinyl)-3-(1,2-oxazinan-2-yl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[3-[[2-(3,4-dimethoxyphenyl)ethyl]methylamino]-1-piperidinyl]-3-(tetrahydro-2H-1,2-oxazin-2-yl)- [ACD/Index Name]
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[3-(1,2-oxazinan-2-yl)propanoyl]-3-piperidinamine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 572.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 299.9±32.9 °C
Index of Refraction: 1.563
Molar Refractivity: 118.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 2.88
ACD/KOC (pH 7.4): 44.71
Polar Surface Area: 54 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 49.4±5.0 dyne/cm
Molar Volume: 364.2±5.0 cm3

Click to predict properties on the Chemicalize site


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