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    CAS 146270-01-1

    PharmaCompass
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    2D Structure
    Also known as: 146270-01-1, Pyridine, 2-chloro-4-(1-piperidinylmethyl)-, 2-chloro-4-(1-piperidinomethyl)pyridine, 2-chloro-4-((piperidin-1-yl)methyl)pyridine, 2-chloro-4-(1-piperidylmethyl)pyridine, 2-chloro-4-[(piperidin-1-yl)methyl]pyridine
    Molecular Formula
    C11H15ClN2
    Molecular Weight
    210.70  g/mol
    InChI Key
    FCGXHPOYGAGSIQ-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-chloro-4-(piperidin-1-ylmethyl)pyridine
    2.1.2 InChI
    InChI=1S/C11H15ClN2/c12-11-8-10(4-5-13-11)9-14-6-2-1-3-7-14/h4-5,8H,1-3,6-7,9H2
    2.1.3 InChI Key
    FCGXHPOYGAGSIQ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CCN(CC1)CC2=CC(=NC=C2)Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 146270-01-1

    2. Pyridine, 2-chloro-4-(1-piperidinylmethyl)-

    3. 2-chloro-4-(1-piperidinomethyl)pyridine

    4. 2-chloro-4-((piperidin-1-yl)methyl)pyridine

    5. 2-chloro-4-(1-piperidylmethyl)pyridine

    6. 2-chloro-4-[(piperidin-1-yl)methyl]pyridine

    7. 2-chloro-4-(1-piperidinylmethyl)pyridine

    8. 2-chloro-4-(1-piperidinylmethyl) Pyridine

    9. Schembl7606866

    10. Dtxsid30431843

    11. Wfa27001

    12. Mfcd02684341

    13. Phenylamino-aceticacidhydrazide

    14. Akos011323907

    15. As-19703

    16. Db-024381

    17. A3188

    18. Cs-0158827

    19. D86945

    20. A1-20556

    21. 2-chloro-4-piperidin-1-ylmethyl-pyridine;2-chloro-4-(1-piperidinomethyl)pyridine

    2.3 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 210.70 g/mol
    Molecular Formula C11H15ClN2
    XLogP32.5
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area16.1
    Heavy Atom Count14
    Formal Charge0
    Complexity169
    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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