ChemSpider 2D Image | 2-Methyl-4-[4-({3-[methyl(2-phenylethyl)amino]-1-piperidinyl}methyl)phenyl]-3-butyn-2-ol | C26H34N2O

2-Methyl-4-[4-({3-[methyl(2-phenylethyl)amino]-1-piperidinyl}methyl)phenyl]-3-butyn-2-ol

  • Molecular FormulaC26H34N2O
  • Average mass390.561 Da
  • Monoisotopic mass390.267120 Da
  • ChemSpider ID22250339

More details:

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

2-Methyl-4-[4-({3-[methyl(2-phenylethyl)amino]-1-piperidinyl}methyl)phenyl]-3-butin-2-ol [German] [ACD/IUPAC Name]
2-Methyl-4-[4-({3-[methyl(2-phenylethyl)amino]-1-piperidinyl}methyl)phenyl]-3-butyn-2-ol [ACD/IUPAC Name]
2-Méthyl-4-[4-({3-[méthyl(2-phényléthyl)amino]-1-pipéridinyl}méthyl)phényl]-3-butyn-2-ol [French] [ACD/IUPAC Name]
3-Butyn-2-ol, 2-methyl-4-[4-[[3-[methyl(2-phenylethyl)amino]-1-piperidinyl]methyl]phenyl]- [ACD/Index Name]
2-METHYL-4-[4-({3-[METHYL(2-PHENYLETHYL)AMINO]PIPERIDIN-1-YL}METHYL)PHENYL]BUT-3-YN-2-OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 526.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.3±3.0 kJ/mol
Flash Point: 245.6±28.8 °C
Index of Refraction: 1.604
Molar Refractivity: 121.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.44
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 8.68
ACD/KOC (pH 7.4): 34.64
Polar Surface Area: 27 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 353.5±5.0 cm3

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