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    CAS 53617-36-0

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    CAS 53617-36-0
    Also known as: 53617-36-0, 1-methyl-4-(4-piperidinyl)piperazine, 1-methyl-4-(piperidin-4-yl)-piperazine, 1-methyl-4-piperidin-4-yl-piperazine, 1-methyl-4-piperidin-4-ylpiperazine, Piperazine, 1-methyl-4-(4-piperidinyl)-
    Molecular Formula
    C10H21N3
    Molecular Weight
    183.29  g/mol
    InChI Key
    MRYYJGQKVGZGSB-UHFFFAOYSA-N
    1 2D Structure

    CAS 53617-36-0

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-methyl-4-piperidin-4-ylpiperazine
    2.1.2 InChI
    InChI=1S/C10H21N3/c1-12-6-8-13(9-7-12)10-2-4-11-5-3-10/h10-11H,2-9H2,1H3
    2.1.3 InChI Key
    MRYYJGQKVGZGSB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1CCN(CC1)C2CCNCC2
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 53617-36-0

    2. 1-methyl-4-(4-piperidinyl)piperazine

    3. 1-methyl-4-(piperidin-4-yl)-piperazine

    4. 1-methyl-4-piperidin-4-yl-piperazine

    5. 1-methyl-4-piperidin-4-ylpiperazine

    6. Piperazine, 1-methyl-4-(4-piperidinyl)-

    7. 99726-99-5

    8. Mfcd03274729

    9. 1-methyl-4-(4-piperidyl)piperazine

    10. 1 Methyl-4-(piperidin-4-yl)piperazine

    11. Oprea1_568221

    12. Oprea1_801469

    13. Schembl383553

    14. Dtxsid30912521

    15. Bcp13916

    16. Cs-m1225

    17. 1-methyl-4-piperidin-4yl-piperazine

    18. Zinc19504179

    19. 1-methyl-4-piperidin-4-yl-piperazin

    20. 4-(1-methyl-4-piperazinyl)piperidine

    21. 4-(1-methylpiperazin-4-yl)piperidine

    22. 4-(4-methyl-1-piperazinyl)piperidine

    23. Akos000185755

    24. Am85307

    25. As-5559

    26. Sb17896

    27. 1-methyl-4-(piperidine-4-yl)piperazine

    28. Ac-30880

    29. Bas 04918778

    30. Sy032225

    31. Db-019256

    32. Bb 0261283

    33. Ft-0640181

    34. 1-methyl-4-(4-piperidyl)piperazine Hydrochoride

    35. A817027

    36. A829687

    37. A851688

    38. A1-50272

    39. J-504944

    40. 1-methyl-4-(piperidin-4-yl)-piperazine, Aldrichcpr

    41. 4-(2,5-dioxo-2,5-dihydro-pyrrol-1-yl)-phthalicacid

    42. 3-(2-methyl-1-piperidyl)-2-phenyl-propan-1-ol;1-methyl-4-(4-piperidinyl)piperazine

    2.3 Create Date
    2005-07-08
    3 Chemical and Physical Properties
    Molecular Weight 183.29 g/mol
    Molecular Formula C10H21N3
    XLogP30.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass183.173547683 g/mol
    Monoisotopic Mass183.173547683 g/mol
    Topological Polar Surface Area18.5 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity146
    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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