ChemSpider 2D Image | N-(2,3-Dimethoxybenzyl)-3-[(3S,4R)-4-(4-morpholinyl)-1-(1-naphthylmethyl)-3-piperidinyl]propanamide | C32H41N3O4

N-(2,3-Dimethoxybenzyl)-3-[(3S,4R)-4-(4-morpholinyl)-1-(1-naphthylmethyl)-3-piperidinyl]propanamide

  • Molecular FormulaC32H41N3O4
  • Average mass531.686 Da
  • Monoisotopic mass531.309692 Da
  • ChemSpider ID22862508

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

3-Piperidinepropanamide, N-[(2,3-dimethoxyphenyl)methyl]-4-(4-morpholinyl)-1-(1-naphthalenylmethyl)-, (3S,4R)- [ACD/Index Name]
N-(2,3-Dimethoxybenzyl)-3-[(3S,4R)-4-(4-morpholinyl)-1-(1-naphthylmethyl)-3-piperidinyl]propanamid [German] [ACD/IUPAC Name]
N-(2,3-Dimethoxybenzyl)-3-[(3S,4R)-4-(4-morpholinyl)-1-(1-naphthylmethyl)-3-piperidinyl]propanamide [ACD/IUPAC Name]
N-(2,3-Diméthoxybenzyl)-3-[(3S,4R)-4-(4-morpholinyl)-1-(1-naphtylméthyl)-3-pipéridinyl]propanamide [French] [ACD/IUPAC Name]
N-(2,3-dimethoxybenzyl)-3-[(3S*,4R*)-4-(4-morpholinyl)-1-(1-naphthylmethyl)-3-piperidinyl]propanamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 704.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 379.9±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 155.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.36
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 26.93
ACD/KOC (pH 7.4): 148.98
Polar Surface Area: 63 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 457.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement