ChemSpider 2D Image | 4-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]carbonyl}-1-methyl-2-piperidinone | C16H29N3O4

4-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]carbonyl}-1-methyl-2-piperidinone

  • Molecular FormulaC16H29N3O4
  • Average mass327.419 Da
  • Monoisotopic mass327.215820 Da
  • ChemSpider ID30357258

More details:

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

2-Piperidinone, 4-[[4-(3-ethoxy-2-hydroxypropyl)-1-piperazinyl]carbonyl]-1-methyl- [ACD/Index Name]
4-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]carbonyl}-1-methyl-2-piperidinon [German] [ACD/IUPAC Name]
4-{[4-(3-Ethoxy-2-hydroxypropyl)-1-piperazinyl]carbonyl}-1-methyl-2-piperidinone [ACD/IUPAC Name]
4-{[4-(3-Éthoxy-2-hydroxypropyl)-1-pipérazinyl]carbonyl}-1-méthyl-2-pipéridinone [French] [ACD/IUPAC Name]
4-[4-(3-ETHOXY-2-HYDROXYPROPYL)PIPERAZINE-1-CARBONYL]-1-METHYLPIPERIDIN-2-ONE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 548.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 95.2±6.0 kJ/mol
Flash Point: 285.8±30.1 °C
Index of Refraction: 1.524
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.24
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.55
ACD/LogD (pH 7.4): -0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.04
Polar Surface Area: 73 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 281.2±3.0 cm3

Click to predict properties on the Chemicalize site


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