ChemSpider 2D Image | (3R,4R)-N-(3,4-Dichlorophenyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)-1-piperidinecarboxamide | C18H24Cl2N2O3

(3R,4R)-N-(3,4-Dichlorophenyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)-1-piperidinecarboxamide

  • Molecular FormulaC18H24Cl2N2O3
  • Average mass387.301 Da
  • Monoisotopic mass386.116394 Da
  • ChemSpider ID29548530

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4R)-N-(3,4-Dichlorophenyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)-1-piperidinecarboxamide [ACD/IUPAC Name]
(3R,4R)-N-(3,4-Dichlorophényl)-4-hydroxy-3-méthyl-4-(tétrahydro-2H-pyran-4-yl)-1-pipéridinecarboxamide [French] [ACD/IUPAC Name]
(3R,4R)-N-(3,4-Dichlorphenyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)-1-piperidincarboxamid [German] [ACD/IUPAC Name]
1-Piperidinecarboxamide, N-(3,4-dichlorophenyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)-, (3R,4R)- [ACD/Index Name]
(3R*,4R*)-N-(3,4-dichlorophenyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)piperidine-1-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 572.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 300.3±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 99.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 268.64
ACD/KOC (pH 5.5): 1907.26
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 268.61
ACD/KOC (pH 7.4): 1907.01
Polar Surface Area: 62 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 57.5±3.0 dyne/cm
Molar Volume: 286.6±3.0 cm3

Click to predict properties on the Chemicalize site


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