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Search term: MKPTVBWRVPEJSU (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-(2-Phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N-(2-phenylethyl)-4-piperidinecarboxamide | C27H30N4O

1-(2-Phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N-(2-phenylethyl)-4-piperidinecarboxamide

  • Molecular FormulaC27H30N4O
  • Average mass426.553 Da
  • Monoisotopic mass426.241974 Da
  • ChemSpider ID22166515

More details:






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

1-(2-Phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N-(2-phenylethyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-(2-Phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N-(2-phenylethyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
1-(2-Phényl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N-(2-phényléthyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-(6,7-dihydro-2-phenyl-5H-cyclopenta[d]pyrimidin-4-yl)-N-(2-phenylethyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 624.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.6±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 125.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 178.69
ACD/KOC (pH 5.5): 623.20
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2661.93
ACD/KOC (pH 7.4): 9283.74
Polar Surface Area: 58 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 54.3±3.0 dyne/cm
Molar Volume: 359.8±3.0 cm3

Click to predict properties on the Chemicalize site






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