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    PharmaCompass

    Chemistry

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    Also known as: 103640-16-0, 6339-83-9, N,n-diethyl-1-methyl-piperidine-4-carboxamide, Schembl2545481, Dtxsid90328644, Zinc1675085
    Molecular Formula
    C11H22N2O
    Molecular Weight
    198.31  g/mol
    InChI Key
    AHNSNPOUOJCUHM-UHFFFAOYSA-N
    CAS 103640-16-0
    1 2D Structure

    CAS 103640-16-0

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N,N-diethyl-1-methylpiperidine-4-carboxamide
    2.1.2 InChI
    InChI=1S/C11H22N2O/c1-4-13(5-2)11(14)10-6-8-12(3)9-7-10/h10H,4-9H2,1-3H3
    2.1.3 InChI Key
    AHNSNPOUOJCUHM-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCN(CC)C(=O)C1CCN(CC1)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 103640-16-0

    2. 6339-83-9

    3. N,n-diethyl-1-methyl-piperidine-4-carboxamide

    4. Schembl2545481

    5. Dtxsid90328644

    6. Zinc1675085

    7. Akos027599242

    8. Db-101522

    9. Cs-0057910

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 198.31 g/mol
    Molecular Formula C11H22N2O
    XLogP31
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area23.6
    Heavy Atom Count14
    Formal Charge0
    Complexity182
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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