ChemSpider 2D Image | (3R,5S)-N,1-Bis(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidinecarboxamide | C29H41N3O6

(3R,5S)-N,1-Bis(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidinecarboxamide

  • Molecular FormulaC29H41N3O6
  • Average mass527.652 Da
  • Monoisotopic mass527.299561 Da
  • ChemSpider ID62706828

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,5S)-N,1-Bis(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidincarboxamid [German] [ACD/IUPAC Name]
(3R,5S)-N,1-Bis(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidinecarboxamide [ACD/IUPAC Name]
(3R,5S)-N,1-Bis(3,4-diméthoxybenzyl)-5-(4-morpholinylméthyl)-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, N,1-bis[(3,4-dimethoxyphenyl)methyl]-5-(4-morpholinylmethyl)-, (3R,5S)- [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: 683.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.2±31.5 °C
Index of Refraction: 1.556
Molar Refractivity: 146.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 1.68
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 3.62
ACD/KOC (pH 7.4): 54.72
Polar Surface Area: 82 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 454.8±3.0 cm3

Click to predict properties on the Chemicalize site


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