ChemSpider 2D Image | (1S,9aR)-1-{[4-(2-Methyl-4-pyridinyl)-1-piperazinyl]methyl}octahydro-2H-quinolizine | C20H32N4

(1S,9aR)-1-{[4-(2-Methyl-4-pyridinyl)-1-piperazinyl]methyl}octahydro-2H-quinolizine

  • Molecular FormulaC20H32N4
  • Average mass328.495 Da
  • Monoisotopic mass328.262695 Da
  • ChemSpider ID29675145

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,9aR)-1-{[4-(2-Methyl-4-pyridinyl)-1-piperazinyl]methyl}octahydro-2H-chinolizin [German] [ACD/IUPAC Name]
(1S,9aR)-1-{[4-(2-Methyl-4-pyridinyl)-1-piperazinyl]methyl}octahydro-2H-quinolizine [ACD/IUPAC Name]
(1S,9aR)-1-{[4-(2-Méthyl-4-pyridinyl)-1-pipérazinyl]méthyl}octahydro-2H-quinolizine [French] [ACD/IUPAC Name]
2H-Quinolizine, octahydro-1-[[4-(2-methyl-4-pyridinyl)-1-piperazinyl]methyl]-, (1S,9aR)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 474.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 240.5±28.7 °C
Index of Refraction: 1.597
Molar Refractivity: 99.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): -1.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 23 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 52.1±5.0 dyne/cm
Molar Volume: 292.1±5.0 cm3

Click to predict properties on the Chemicalize site


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