ChemSpider 2D Image | N-Benzyl-6-{3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]oct-8-yl}nicotinamide | C29H32N4O3

N-Benzyl-6-{3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]oct-8-yl}nicotinamide

  • Molecular FormulaC29H32N4O3
  • Average mass484.589 Da
  • Monoisotopic mass484.247437 Da
  • ChemSpider ID28649476

More details:

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

3-Pyridinecarboxamide, 6-[3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]oct-8-yl]-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-6-{3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]oct-8-yl}nicotinamid [German] [ACD/IUPAC Name]
N-Benzyl-6-{3-[(3-methoxy-2-methylbenzoyl)amino]-8-azabicyclo[3.2.1]oct-8-yl}nicotinamide [ACD/IUPAC Name]
N-Benzyl-6-{3-[(3-méthoxy-2-méthylbenzoyl)amino]-8-azabicyclo[3.2.1]oct-8-yl}nicotinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 720.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.2±3.0 kJ/mol
Flash Point: 389.3±32.9 °C
Index of Refraction: 1.647
Molar Refractivity: 138.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 80.80
ACD/KOC (pH 5.5): 475.27
ACD/LogD (pH 7.4): 3.85
ACD/BCF (pH 7.4): 486.83
ACD/KOC (pH 7.4): 2863.55
Polar Surface Area: 84 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 62.1±5.0 dyne/cm
Molar Volume: 381.4±5.0 cm3

Click to predict properties on the Chemicalize site


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