ChemSpider 2D Image | N-(2,4-Dimethoxyphenyl)-3-[(3S,4R)-4-(dimethylamino)-1-(2-naphthylmethyl)-3-piperidinyl]propanamide | C29H37N3O3

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

  • Molecular FormulaC29H37N3O3
  • Average mass475.622 Da
  • Monoisotopic mass475.283478 Da
  • ChemSpider ID22836536

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

3-Piperidinepropanamide, N-(2,4-dimethoxyphenyl)-4-(dimethylamino)-1-(2-naphthalenylmethyl)-, (3S,4R)- [ACD/Index Name]
N-(2,4-Dimethoxyphenyl)-3-[(3S,4R)-4-(dimethylamino)-1-(2-naphthylmethyl)-3-piperidinyl]propanamid [German] [ACD/IUPAC Name]
N-(2,4-Dimethoxyphenyl)-3-[(3S,4R)-4-(dimethylamino)-1-(2-naphthylmethyl)-3-piperidinyl]propanamide [ACD/IUPAC Name]
N-(2,4-Diméthoxyphényl)-3-[(3S,4R)-4-(diméthylamino)-1-(2-naphtylméthyl)-3-pipéridinyl]propanamide [French] [ACD/IUPAC Name]
N-(2,4-dimethoxyphenyl)-3-[(3S*,4R*)-4-(dimethylamino)-1-(2-naphthylmethyl)-3-piperidinyl]propanamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 640.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 341.2±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 142.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.13
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 40.65
ACD/KOC (pH 7.4): 149.55
Polar Surface Area: 54 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 52.7±5.0 dyne/cm
Molar Volume: 405.6±5.0 cm3

Click to predict properties on the Chemicalize site


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