ChemSpider 2D Image | 4-Phenyl-N-(3-{4-[(3-pyridinylmethyl)amino]-1-piperidinyl}phenyl)butanamide | C27H32N4O

4-Phenyl-N-(3-{4-[(3-pyridinylmethyl)amino]-1-piperidinyl}phenyl)butanamide

  • Molecular FormulaC27H32N4O
  • Average mass428.569 Da
  • Monoisotopic mass428.257599 Da
  • ChemSpider ID22161388

More details:

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

4-Phenyl-N-(3-{4-[(3-pyridinylmethyl)amino]-1-piperidinyl}phenyl)butanamid [German] [ACD/IUPAC Name]
4-Phenyl-N-(3-{4-[(3-pyridinylmethyl)amino]-1-piperidinyl}phenyl)butanamide [ACD/IUPAC Name]
4-Phényl-N-(3-{4-[(3-pyridinylméthyl)amino]-1-pipéridinyl}phényl)butanamide [French] [ACD/IUPAC Name]
Benzenebutanamide, N-[3-[4-[(3-pyridinylmethyl)amino]-1-piperidinyl]phenyl]- [ACD/Index Name]
4-PHENYL-N-(3-{4-[(PYRIDIN-3-YLMETHYL)AMINO]PIPERIDIN-1-YL}PHENYL)BUTANAMIDE
4-PHENYL-N-[3-(4-{[(PYRIDIN-3-YL)METHYL]AMINO}PIPERIDIN-1-YL)PHENYL]BUTANAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 673.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.9±3.0 kJ/mol
Flash Point: 361.1±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 129.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 10.96
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 103.19
ACD/KOC (pH 7.4): 554.41
Polar Surface Area: 57 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 365.0±5.0 cm3

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