ChemSpider 2D Image | (3R,5S)-N-Butyl-1-(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidinecarboxamide | C24H39N3O4

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

  • Molecular FormulaC24H39N3O4
  • Average mass433.584 Da
  • Monoisotopic mass433.294067 Da
  • ChemSpider ID29656285

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,5S)-N-Butyl-1-(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidincarboxamid [German] [ACD/IUPAC Name]
(3R,5S)-N-Butyl-1-(3,4-dimethoxybenzyl)-5-(4-morpholinylmethyl)-3-piperidinecarboxamide [ACD/IUPAC Name]
(3R,5S)-N-Butyl-1-(3,4-diméthoxybenzyl)-5-(4-morpholinylméthyl)-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, N-butyl-1-[(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: 1.1±0.1 g/cm3
Boiling Point: 585.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.6±30.1 °C
Index of Refraction: 1.530
Molar Refractivity: 122.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): -1.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 2.58
ACD/KOC (pH 7.4): 42.11
Polar Surface Area: 63 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 395.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement