ChemSpider 2D Image | 6-(4-Acetamidobenzyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide | C25H28F3N3O2

6-(4-Acetamidobenzyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide

  • Molecular FormulaC25H28F3N3O2
  • Average mass459.504 Da
  • Monoisotopic mass459.213348 Da
  • ChemSpider ID22156540

More details:

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

6-(4-Acetamidobenzyl)-N-[2-(trifluormethyl)benzyl]-6-azaspiro[2.5]octan-1-carboxamid [German] [ACD/IUPAC Name]
6-(4-Acetamidobenzyl)-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [ACD/IUPAC Name]
6-(4-Acétamidobenzyl)-N-[2-(trifluorométhyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [French] [ACD/IUPAC Name]
6-Azaspiro[2.5]octane-1-carboxamide, 6-[[4-(acetylamino)phenyl]methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]- [ACD/Index Name]
6-[(4-ACETAMIDOPHENYL)METHYL]-N-{[2-(TRIFLUOROMETHYL)PHENYL]METHYL}-6-AZASPIRO[2.5]OCTANE-1-CARBOXAMIDE
6-[4-(acetylamino)benzyl]-N-[2-(trifluoromethyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 648.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 346.1±31.5 °C
Index of Refraction: 1.587
Molar Refractivity: 119.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 1.40
ACD/KOC (pH 7.4): 13.88
Polar Surface Area: 61 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 50.6±5.0 dyne/cm
Molar Volume: 355.0±5.0 cm3

Click to predict properties on the Chemicalize site


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