ChemSpider 2D Image | N-(Adamantan-1-yl)-1-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide | C25H26FN3O

N-(Adamantan-1-yl)-1-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

  • Molecular FormulaC25H26FN3O
  • Average mass403.492 Da
  • Monoisotopic mass403.205994 Da
  • ChemSpider ID118210297

More details:

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

1H-Pyrrolo[2,3-b]pyridine-3-carboxamide, 1-[(4-fluorophenyl)methyl]-N-tricyclo[3.3.1.13,7]dec-1-yl- [ACD/Index Name]
N-(Adamantan-1-yl)-1-(4-fluorbenzyl)-1H-pyrrolo[2,3-b]pyridin-3-carboxamid [German] [ACD/IUPAC Name]
N-(Adamantan-1-yl)-1-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide [ACD/IUPAC Name]
N-(Adamantan-1-yl)-1-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 644.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 343.7±30.1 °C
Index of Refraction: 1.716
Molar Refractivity: 113.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2437.35
ACD/KOC (pH 5.5): 9198.40
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2481.40
ACD/KOC (pH 7.4): 9364.63
Polar Surface Area: 47 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 54.2±7.0 dyne/cm
Molar Volume: 289.4±7.0 cm3

Click to predict properties on the Chemicalize site


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