ChemSpider 2D Image | 1-(Cyclohexylmethyl)-N-(1-{[2-(2-hydroxyethoxy)ethyl]amino}-2-methyl-1-oxo-2-propanyl)-2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3-carboxamide | C27H43N3O5

1-(Cyclohexylmethyl)-N-(1-{[2-(2-hydroxyethoxy)ethyl]amino}-2-methyl-1-oxo-2-propanyl)-2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3-carboxamide

  • Molecular FormulaC27H43N3O5
  • Average mass489.647 Da
  • Monoisotopic mass489.320282 Da
  • ChemSpider ID28531424

More details:

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

1-(Cyclohexylmethyl)-N-(1-{[2-(2-hydroxyethoxy)ethyl]amino}-2-methyl-1-oxo-2-propanyl)-2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridin-3-carboxamid [German] [ACD/IUPAC Name]
1-(Cyclohexylmethyl)-N-(1-{[2-(2-hydroxyethoxy)ethyl]amino}-2-methyl-1-oxo-2-propanyl)-2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3-carboxamide [ACD/IUPAC Name]
1-(Cyclohexylméthyl)-N-(1-{[2-(2-hydroxyéthoxy)éthyl]amino}-2-méthyl-1-oxo-2-propanyl)-2-oxo-1,2,5,6,7,8,9,10-octahydrocycloocta[b]pyridine-3-carboxamide [French] [ACD/IUPAC Name]
Cycloocta[b]pyridine-3-carboxamide, 1-(cyclohexylmethyl)-1,2,5,6,7,8,9,10-octahydro-N-[2-[[2-(2-hydroxyethoxy)ethyl]amino]-1,1-dimethyl-2-oxoethyl]-2-oxo- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 810.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 134.2±6.0 kJ/mol
Flash Point: 444.1±34.3 °C
Index of Refraction: 1.561
Molar Refractivity: 134.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 82.31
ACD/KOC (pH 5.5): 817.88
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 82.29
ACD/KOC (pH 7.4): 817.64
Polar Surface Area: 108 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 416.8±5.0 cm3

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