ChemSpider 2D Image | 1-(3-{[Benzyl(isopropyl)amino]methyl}-1-pyrrolidinyl)-2-chloroethanone | C17H25ClN2O

1-(3-{[Benzyl(isopropyl)amino]methyl}-1-pyrrolidinyl)-2-chloroethanone

  • Molecular FormulaC17H25ClN2O
  • Average mass308.846 Da
  • Monoisotopic mass308.165527 Da
  • ChemSpider ID28300290

More details:

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

1-(3-{[Benzyl(isopropyl)amino]methyl}-1-pyrrolidinyl)-2-chlorethanon [German] [ACD/IUPAC Name]
1-(3-{[Benzyl(isopropyl)amino]methyl}-1-pyrrolidinyl)-2-chloroethanone [ACD/IUPAC Name]
1-(3-{[Benzyl(isopropyl)amino]méthyl}-1-pyrrolidinyl)-2-chloroéthanone [French] [ACD/IUPAC Name]
1-(3-{[BENZYL(PROPAN-2-YL)AMINO]METHYL}PYRROLIDIN-1-YL)-2-CHLOROETHAN-1-ONE
1353963-67-3 [RN]
Ethanone, 2-chloro-1-[3-[[(1-methylethyl)(phenylmethyl)amino]methyl]-1-pyrrolidinyl]- [ACD/Index Name]
1-(3-((Benzyl(isopropyl)amino)methyl)pyrrolidin-1-yl)-2-chloroethanone
1-(3-{[BENZYL(ISOPROPYL)AMINO]METHYL}PYRROLIDIN-1-YL)-2-CHLOROETHANONE
1-{3-[(Benzyl-isopropyl-amino)-methyl ]-pyrrolidin-1-yl}-2-chloro-ethanone
1-{3-[(benzylisopropylamino)methyl]pyrrolidin-1-yl}-2-chloroethanone
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 424.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 210.4±23.2 °C
Index of Refraction: 1.542
Molar Refractivity: 87.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.16
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 3.77
ACD/KOC (pH 7.4): 36.61
Polar Surface Area: 24 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 277.8±3.0 cm3

Click to predict properties on the Chemicalize site


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