ChemSpider 2D Image | N-(1-{1-[(6-Methyl-2-pyridinyl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)-4-phenylbutanamide | C25H31N5O

N-(1-{1-[(6-Methyl-2-pyridinyl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)-4-phenylbutanamide

  • Molecular FormulaC25H31N5O
  • Average mass417.547 Da
  • Monoisotopic mass417.252869 Da
  • ChemSpider ID22208084

More details:

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

Benzenebutanamide, N-[1-[1-[(6-methyl-2-pyridinyl)methyl]-4-piperidinyl]-1H-pyrazol-5-yl]- [ACD/Index Name]
N-(1-{1-[(6-Methyl-2-pyridinyl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)-4-phenylbutanamid [German] [ACD/IUPAC Name]
N-(1-{1-[(6-Methyl-2-pyridinyl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)-4-phenylbutanamide [ACD/IUPAC Name]
N-(1-{1-[(6-Méthyl-2-pyridinyl)méthyl]-4-pipéridinyl}-1H-pyrazol-5-yl)-4-phénylbutanamide [French] [ACD/IUPAC Name]
N-(1-{1-[(6-METHYLPYRIDIN-2-YL)METHYL]PIPERIDIN-4-YL}-1H-PYRAZOL-5-YL)-4-PHENYLBUTANAMIDE
N-(2-{1-[(6-METHYLPYRIDIN-2-YL)METHYL]PIPERIDIN-4-YL}PYRAZOL-3-YL)-4-PHENYLBUTANAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 629.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.6±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 125.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 13.18
ACD/KOC (pH 5.5): 107.48
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 143.83
ACD/KOC (pH 7.4): 1173.26
Polar Surface Area: 63 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 352.8±7.0 cm3

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