ChemSpider 2D Image | 1-{5-[(2S)-1-Methyl-2-piperidinyl]-3,4-dihydro-1(2H)-pyridinyl}ethanone | C13H22N2O

1-{5-[(2S)-1-Methyl-2-piperidinyl]-3,4-dihydro-1(2H)-pyridinyl}ethanone

  • Molecular FormulaC13H22N2O
  • Average mass222.327 Da
  • Monoisotopic mass222.173218 Da
  • ChemSpider ID24655131

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-{5-[(2S)-1-Methyl-2-piperidinyl]-3,4-dihydro-1(2H)-pyridinyl}ethanon [German] [ACD/IUPAC Name]
1-{5-[(2S)-1-Methyl-2-piperidinyl]-3,4-dihydro-1(2H)-pyridinyl}ethanone [ACD/IUPAC Name]
1-{5-[(2S)-1-Méthyl-2-pipéridinyl]-3,4-dihydro-1(2H)-pyridinyl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[3,4-dihydro-5-[(2S)-1-methyl-2-piperidinyl]-1(2H)-pyridinyl]- [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: 362.2±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.8±3.0 kJ/mol
Flash Point: 153.7±20.0 °C
Index of Refraction: 1.526
Molar Refractivity: 64.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): -1.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 24 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 211.2±3.0 cm3

Click to predict properties on the Chemicalize site


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