ChemSpider 2D Image | N-(4-{[4-(4-Morpholinylmethyl)benzyl]amino}-4-oxobutyl)-1-adamantanecarboxamide | C27H39N3O3

N-(4-{[4-(4-Morpholinylmethyl)benzyl]amino}-4-oxobutyl)-1-adamantanecarboxamide

  • Molecular FormulaC27H39N3O3
  • Average mass453.617 Da
  • Monoisotopic mass453.299133 Da
  • ChemSpider ID22550303

More details:

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

N-(4-{[4-(4-Morpholinylmethyl)benzyl]amino}-4-oxobutyl)-1-adamantancarboxamid [German] [ACD/IUPAC Name]
N-(4-{[4-(4-Morpholinylmethyl)benzyl]amino}-4-oxobutyl)-1-adamantanecarboxamide [ACD/IUPAC Name]
N-(4-{[4-(4-Morpholinylméthyl)benzyl]amino}-4-oxobutyl)-1-adamantanecarboxamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxamide, N-[4-[[[4-(4-morpholinylmethyl)phenyl]methyl]amino]-4-oxobutyl]- [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: 701.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 377.8±32.9 °C
Index of Refraction: 1.581
Molar Refractivity: 128.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 6.16
ACD/KOC (pH 5.5): 61.96
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 68.68
ACD/KOC (pH 7.4): 690.50
Polar Surface Area: 71 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 384.4±3.0 cm3

Click to predict properties on the Chemicalize site


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