ChemSpider 2D Image | 3-Amino-6-methoxy-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)-2-pyridinecarboxamide | C12H13F6N3O3

3-Amino-6-methoxy-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)-2-pyridinecarboxamide

  • Molecular FormulaC12H13F6N3O3
  • Average mass361.240 Da
  • Monoisotopic mass361.086121 Da
  • ChemSpider ID88296259

More details:

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

2-Pyridinecarboxamide, 3-amino-6-methoxy-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)- [ACD/Index Name]
3-Amino-6-methoxy-N-(3,3,3-trifluor-2-hydroxy-2-methylpropyl)-5-(trifluormethyl)-2-pyridincarboxamid [German] [ACD/IUPAC Name]
3-Amino-6-methoxy-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)-2-pyridinecarboxamide [ACD/IUPAC Name]
3-Amino-6-méthoxy-N-(3,3,3-trifluoro-2-hydroxy-2-méthylpropyl)-5-(trifluorométhyl)-2-pyridinecarboxamide [French] [ACD/IUPAC Name]
1334546-77-8 [RN]
3-amino-6-methoxy-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)pyridine-2-carboxamide
Icenticaftor

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

Density: 1.5±0.1 g/cm3
Boiling Point: 440.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 219.9±28.7 °C
Index of Refraction: 1.478
Molar Refractivity: 69.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 116.64
ACD/KOC (pH 5.5): 1049.66
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 116.63
ACD/KOC (pH 7.4): 1049.59
Polar Surface Area: 97 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 246.3±3.0 cm3

Click to predict properties on the Chemicalize site


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