ChemSpider 2D Image | (3S)-N-(2-AMINOETHYL)-1-BENZYL-N-METHYLPIPERIDIN-3-AMINE | C15H25N3

(3S)-N-(2-AMINOETHYL)-1-BENZYL-N-METHYLPIPERIDIN-3-AMINE

  • Molecular FormulaC15H25N3
  • Average mass247.379 Da
  • Monoisotopic mass247.204849 Da
  • ChemSpider ID28298208

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-N-(2-AMINOETHYL)-1-BENZYL-N-METHYLPIPERIDIN-3-AMINE
1,2-Ethanediamine, N1-methyl-N1-[(3S)-1-(phenylmethyl)-3-piperidinyl]- [ACD/Index Name]
1354015-57-8 [RN]
N-[(3S)-1-Benzyl-3-piperidinyl]-N-methyl-1,2-ethandiamin [German] [ACD/IUPAC Name]
N-[(3S)-1-Benzyl-3-piperidinyl]-N-methyl-1,2-ethanediamine [ACD/IUPAC Name]
N-[(3S)-1-Benzyl-3-pipéridinyl]-N-méthyl-1,2-éthanediamine [French] [ACD/IUPAC Name]
(S)-N1-(1-Benzylpiperidin-3-yl)-N1-methylethane-1,2-diamine
MFCD21093521
N*1*-((S)-1-benzylpiperidin-3-yl)-N*1*-methylethane-1,2-diamine
N*1*-((S)-1-benzylpiperidin-3-yl)-N*1*-methyl-ethane-1,2-diamine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 347.4±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.2±3.0 kJ/mol
    Flash Point: 161.5±21.3 °C
    Index of Refraction: 1.572
    Molar Refractivity: 77.7±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.10
    ACD/LogD (pH 5.5): -2.63
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.33
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 33 Å2
    Polarizability: 30.8±0.5 10-24cm3
    Surface Tension: 45.8±5.0 dyne/cm
    Molar Volume: 236.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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