ChemSpider 2D Image | N'-{4-[4-(2-Chlorophenyl)-4-piperidinyl]-2-pyrimidinyl}-N,N-dimethyl-1,3-propanediamine | C20H28ClN5

N'-{4-[4-(2-Chlorophenyl)-4-piperidinyl]-2-pyrimidinyl}-N,N-dimethyl-1,3-propanediamine

  • Molecular FormulaC20H28ClN5
  • Average mass373.923 Da
  • Monoisotopic mass373.203339 Da
  • ChemSpider ID29688295

More details:

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

1,3-Propanediamine, N3-[4-[4-(2-chlorophenyl)-4-piperidinyl]-2-pyrimidinyl]-N1,N1-dimethyl- [ACD/Index Name]
N'-{4-[4-(2-Chlorophenyl)-4-piperidinyl]-2-pyrimidinyl}-N,N-dimethyl-1,3-propanediamine [ACD/IUPAC Name]
N'-{4-[4-(2-Chlorophényl)-4-pipéridinyl]-2-pyrimidinyl}-N,N-diméthyl-1,3-propanediamine [French] [ACD/IUPAC Name]
N'-{4-[4-(2-Chlorphenyl)-4-piperidinyl]-2-pyrimidinyl}-N,N-dimethyl-1,3-propandiamin [German] [ACD/IUPAC Name]
4-[4-(2-CHLOROPHENYL)PIPERIDIN-4-YL]-N-[3-(DIMETHYLAMINO)PROPYL]PYRIMIDIN-2-AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 526.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.1±3.0 kJ/mol
Flash Point: 272.2±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 108.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): -1.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 53 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 320.4±3.0 cm3

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