ChemSpider 2D Image | 5-{[3-(1-Piperidinylmethyl)-1-pyrrolidinyl]sulfonyl}pentanenitrile | C15H27N3O2S

5-{[3-(1-Piperidinylmethyl)-1-pyrrolidinyl]sulfonyl}pentanenitrile

  • Molecular FormulaC15H27N3O2S
  • Average mass313.459 Da
  • Monoisotopic mass313.182404 Da
  • ChemSpider ID30464886

More details:

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

5-{[3-(1-Piperidinylmethyl)-1-pyrrolidinyl]sulfonyl}pentanenitrile [ACD/IUPAC Name]
5-{[3-(1-Pipéridinylméthyl)-1-pyrrolidinyl]sulfonyl}pentanenitrile [French] [ACD/IUPAC Name]
5-{[3-(1-Piperidinylmethyl)-1-pyrrolidinyl]sulfonyl}pentannitril [German] [ACD/IUPAC Name]
Pentanenitrile, 5-[[3-(1-piperidinylmethyl)-1-pyrrolidinyl]sulfonyl]- [ACD/Index Name]
5-({3-[(PIPERIDIN-1-YL)METHYL]PYRROLIDIN-1-YL}SULFONYL)PENTANENITRILE
5-[3-(PIPERIDIN-1-YLMETHYL)PYRROLIDIN-1-YLSULFONYL]PENTANENITRILE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 486.5±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 248.1±30.4 °C
Index of Refraction: 1.546
Molar Refractivity: 83.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): -1.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 265.2±5.0 cm3

Click to predict properties on the Chemicalize site


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