ChemSpider 2D Image | 6-{[4-(Adamantan-1-yl)-1-piperazinyl]methyl}-N-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-2-oxo-1,2-dihydro-3-pyridinecarboxamide | C32H43N5O2

6-{[4-(Adamantan-1-yl)-1-piperazinyl]methyl}-N-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-2-oxo-1,2-dihydro-3-pyridinecarboxamide

  • Molecular FormulaC32H43N5O2
  • Average mass529.716 Da
  • Monoisotopic mass529.341675 Da
  • ChemSpider ID22153890

More details:

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

3-Pyridinecarboxamide, 1,2-dihydro-2-oxo-N-[(1,2,3,4-tetrahydro-1-methyl-6-quinolinyl)methyl]-6-[(4-tricyclo[3.3.1.13,7]dec-1-yl-1-piperazinyl)methyl]- [ACD/Index Name]
6-{[4-(Adamantan-1-yl)-1-piperazinyl]methyl}-N-[(1-methyl-1,2,3,4-tetrahydro-6-chinolinyl)methyl]-2-oxo-1,2-dihydro-3-pyridincarboxamid [German] [ACD/IUPAC Name]
6-{[4-(Adamantan-1-yl)-1-pipérazinyl]méthyl}-N-[(1-méthyl-1,2,3,4-tétrahydro-6-quinoléinyl)méthyl]-2-oxo-1,2-dihydro-3-pyridinecarboxamide [French] [ACD/IUPAC Name]
6-{[4-(Adamantan-1-yl)-1-piperazinyl]methyl}-N-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-2-oxo-1,2-dihydro-3-pyridinecarboxamide [ACD/IUPAC Name]
6-{[4-(1-adamantyl)-1-piperazinyl]methyl}-N-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-2-oxo-1,2-dihydro-3-pyridinecarboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 790.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 114.9±3.0 kJ/mol
Flash Point: 431.6±32.9 °C
Index of Refraction: 1.624
Molar Refractivity: 151.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 9.65
ACD/KOC (pH 7.4): 104.07
Polar Surface Area: 68 Å2
Polarizability: 60.2±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 430.3±3.0 cm3

Click to predict properties on the Chemicalize site


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