ChemSpider 2D Image | N-(4-Fluorobenzyl)-3-[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]propanamide | C19H29FN2O3

N-(4-Fluorobenzyl)-3-[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]propanamide

  • Molecular FormulaC19H29FN2O3
  • Average mass352.444 Da
  • Monoisotopic mass352.216217 Da
  • ChemSpider ID29737121

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Piperidinepropanamide, N-[(4-fluorophenyl)methyl]-4-hydroxy-4-(2-methoxyethyl)-3-methyl-, (3R,4R)- [ACD/Index Name]
N-(4-Fluorbenzyl)-3-[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]propanamid [German] [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-3-[(3R,4R)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]propanamide [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-3-[(3R,4R)-4-hydroxy-4-(2-méthoxyéthyl)-3-méthyl-1-pipéridinyl]propanamide [French] [ACD/IUPAC Name]
N-(4-fluorobenzyl)-3-[(3R*,4R*)-4-hydroxy-4-(2-methoxyethyl)-3-methyl-1-piperidinyl]propanamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 531.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 275.2±30.1 °C
Index of Refraction: 1.517
Molar Refractivity: 95.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.86
ACD/LogD (pH 5.5): -0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 2.15
ACD/KOC (pH 7.4): 38.63
Polar Surface Area: 62 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 314.8±3.0 cm3

Click to predict properties on the Chemicalize site


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