ChemSpider 2D Image | N-Ethyl-2-fluoro-N-[(6R,7R)-6-hydroxy-7-(4-phenyl-1-piperidinyl)-5,6,7,8-tetrahydro-1-naphthalenyl]acetamide | C25H31FN2O2

N-Ethyl-2-fluoro-N-[(6R,7R)-6-hydroxy-7-(4-phenyl-1-piperidinyl)-5,6,7,8-tetrahydro-1-naphthalenyl]acetamide

  • Molecular FormulaC25H31FN2O2
  • Average mass410.524 Da
  • Monoisotopic mass410.236969 Da
  • ChemSpider ID23317469

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acetamide, N-ethyl-2-fluoro-N-[(6R,7R)-5,6,7,8-tetrahydro-6-hydroxy-7-(4-phenyl-1-piperidinyl)-1-naphthalenyl]- [ACD/Index Name]
N-Ethyl-2-fluor-N-[(6R,7R)-6-hydroxy-7-(4-phenyl-1-piperidinyl)-5,6,7,8-tetrahydro-1-naphthalinyl]acetamid [German] [ACD/IUPAC Name]
N-Éthyl-2-fluoro-N-[(6R,7R)-6-hydroxy-7-(4-phényl-1-pipéridinyl)-5,6,7,8-tétrahydro-1-naphtalényl]acétamide [French] [ACD/IUPAC Name]
N-Ethyl-2-fluoro-N-[(6R,7R)-6-hydroxy-7-(4-phenyl-1-piperidinyl)-5,6,7,8-tetrahydro-1-naphthalenyl]acetamide [ACD/IUPAC Name]
N-ethyl-2-fluoro-N-[(6R,7R)-6-hydroxy-7-(4-phenylpiperidin-1-yl)-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL262612/
trans-N-ethyl-2-fluoro-N-(6-hydroxy-7-(4-phenylpiperidin-1-yl)-5,6,7,8-tetrahydronaphthalen-1-yl)acetamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 598.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 315.8±30.1 °C
Index of Refraction: 1.603
Molar Refractivity: 117.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.65
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 30.08
ACD/KOC (pH 7.4): 232.95
Polar Surface Area: 44 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 342.2±3.0 cm3

Click to predict properties on the Chemicalize site


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