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    Pitolisant Hydrochloride

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    2D Structure
    Also known as: 903576-44-3, Ciproxidine, Bf 2649, Pitolisant hcl, Pitolisant (hydrochloride), Bf 2649 hydrochloride
    Molecular Formula
    C17H27Cl2NO
    Molecular Weight
    332.3  g/mol
    InChI Key
    XLFKECRRMPOAQS-UHFFFAOYSA-N
    FDA UNII
    YV33CH63HI
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-[3-[3-(4-chlorophenyl)propoxy]propyl]piperidine;hydrochloride
    2.1.2 InChI
    InChI=1S/C17H26ClNO.ClH/c18-17-9-7-16(8-10-17)6-4-14-20-15-5-13-19-11-2-1-3-12-19;/h7-10H,1-6,11-15H2;1H
    2.1.3 InChI Key
    XLFKECRRMPOAQS-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CCN(CC1)CCCOCCCC2=CC=C(C=C2)Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    YV33CH63HI
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 903576-44-3

    2. Ciproxidine

    3. Bf 2649

    4. Pitolisant Hcl

    5. Pitolisant (hydrochloride)

    6. Bf 2649 Hydrochloride

    7. Yv33ch63hi

    8. Pitolisant Hydrochloride [usan]

    9. 1-(3-(3-(4-chlorophenyl)propoxy)propyl)piperidine Hydrochloride

    10. Piperidine, 1-[3-[3-(4-chlorophenyl)propoxy]propyl]-, Hydrochloride

    11. 903576-44-3 (hcl)

    12. Wakix (tn)

    13. Pitolisant Hydrochloride (usan)

    14. 1-[3-[3-(4-chlorophenyl)propoxy]propyl]-piperidine Hydrochloride

    15. 1-{3-[3-(4-chlorophenyl)propoxy]propyl}piperidine Hydrochloride

    16. Piperidine, 1-(3-(3-(4-chlorophenyl)propoxy)propyl)-, Hydrochloride

    17. Bf 2.649

    18. Unii-yv33ch63hi

    19. Schembl4591893

    20. Bf-2649 Hydrochloride

    21. Chembl4164059

    22. Dtxsid50238098

    23. Pitolisant;ciproxidine; Bf2649

    24. Amy23423

    25. Bcp16427

    26. Ex-a1420

    27. Hy-12199b

    28. Pitolisant Hydrochloride [mi]

    29. S5926

    30. Akos024457784

    31. Cs-1501

    32. Sb17036

    33. Pitolisant Hydrochloride [who-dd]

    34. Ac-36017

    35. As-72196

    36. A3727

    37. Pitolisant Hydrochloride [orange Book]

    38. C77058

    39. D11490

    40. A900088

    41. Q27895485

    42. 1-[3-[3-(4-chlorophenyl)propoxy]propyl]piperidine;hydrochloride

    43. 1-(3-(3-(4-chlorophenyl)propoxy)propyl)piperidine Monohydrochloride

    44. Piperidine, 1-(3-(3-(4-chlorophenyl)propoxy)propyl)-, Hydrochloride (1:1)

    2.4 Create Date
    2006-10-26
    3 Chemical and Physical Properties
    Molecular Weight 332.3 g/mol
    Molecular Formula C17H27Cl2NO
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count8
    Exact Mass331.1469699 g/mol
    Monoisotopic Mass331.1469699 g/mol
    Topological Polar Surface Area12.5 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity235
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2