ChemSpider 2D Image | 1-(4-Cyanobutyl)-N-(2-phenyl-2-propanyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide | C22H24N4O

1-(4-Cyanobutyl)-N-(2-phenyl-2-propanyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

  • Molecular FormulaC22H24N4O
  • Average mass360.452 Da
  • Monoisotopic mass360.195007 Da
  • ChemSpider ID84427667

More details:






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

1-(4-Cyanbutyl)-N-(2-phenyl-2-propanyl)-1H-pyrrolo[2,3-b]pyridin-3-carboxamid [German] [ACD/IUPAC Name]
1-(4-Cyanobutyl)-N-(2-phenyl-2-propanyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide [ACD/IUPAC Name]
1-(4-Cyanobutyl)-N-(2-phényl-2-propanyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrrolo[2,3-b]pyridine-3-carboxamide, 1-(4-cyanobutyl)-N-(1-methyl-1-phenylethyl)- [ACD/Index Name]
1-(4-Cyanobutyl)-N-(1-methyl-1-phenylethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
2160555-53-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 648.6±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: 1.601
Molar Refractivity: 109.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 285.58
ACD/KOC (pH 5.5): 1974.77
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 294.63
ACD/KOC (pH 7.4): 2037.35
Polar Surface Area: 71 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 319.0±7.0 cm3

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