ChemSpider 2D Image | (2S)-N-[(2S)-1-(4'-Cyano-4-biphenylyl)-3-imino-2-propanyl]-2-piperidinecarboxamide | C22H24N4O

(2S)-N-[(2S)-1-(4'-Cyano-4-biphenylyl)-3-imino-2-propanyl]-2-piperidinecarboxamide

  • Molecular FormulaC22H24N4O
  • Average mass360.452 Da
  • Monoisotopic mass360.195007 Da
  • ChemSpider ID35035971

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-N-[(2S)-1-(4'-Cyan-4-biphenylyl)-3-imino-2-propanyl]-2-piperidincarboxamid [German] [ACD/IUPAC Name]
(2S)-N-[(2S)-1-(4'-Cyano-4-biphenylyl)-3-imino-2-propanyl]-2-piperidinecarboxamide [ACD/IUPAC Name]
(2S)-N-[(2S)-1-(4'-Cyano-4-biphénylyl)-3-imino-2-propanyl]-2-pipéridinecarboxamide [French] [ACD/IUPAC Name]
2-Piperidinecarboxamide, N-[(1S)-2-(4'-cyano[1,1'-biphenyl]-4-yl)-1-(iminomethyl)ethyl]-, (2S)- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.629
Molar Refractivity: 107.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): -1.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 1.39
ACD/KOC (pH 7.4): 15.55
Polar Surface Area: 89 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 49.4±7.0 dyne/cm
Molar Volume: 301.3±7.0 cm3

Click to predict properties on the Chemicalize site


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