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    Ipidacrine Hydrochloride Hydrate

    ACTIVE PHARMA INGREDIENTS

    MARKET PLACE

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 118499-70-0, Ipidacrine hcl hydrate, 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine hydrochloride hydrate, Senita, Ipidacrine hydrochloride monohydrate, Nik-247
    Molecular Formula
    C12H19ClN2O
    Molecular Weight
    242.74  g/mol
    InChI Key
    SBTIBNSPYUUNGA-UHFFFAOYSA-N
    FDA UNII
    OV96AIK79Q
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-amine;hydrate;hydrochloride
    2.1.2 InChI
    InChI=1S/C12H16N2.ClH.H2O/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12;;/h1-7H2,(H2,13,14);1H;1H2
    2.1.3 InChI Key
    SBTIBNSPYUUNGA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CCC2=C(C1)C(=C3CCCC3=N2)N.O.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    OV96AIK79Q
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 118499-70-0

    2. Ipidacrine Hcl Hydrate

    3. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine Hydrochloride Hydrate

    4. Senita

    5. Ipidacrine Hydrochloride Monohydrate

    6. Nik-247

    7. Ipidacrine Hydrochloride Hydrate [jan]

    8. Ipidacrine Monohydrochloride Monohydrate

    9. Ov96aik79q

    10. Ncgc00167585-01

    11. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine;hydrate;hydrochloride

    12. 1h-cyclopenta(b)quinolin-9-amine, 2,3,5,6,7,8-hexahydro-, Hydrochloride, Hydrate (1:1:1)

    13. 1h-cyclopenta(b)quinolin-9-amine, 2,3,5,6,7,8-hexahydro-, Monohydrochloride, Monohydrate

    14. Dsstox_cid_26734

    15. Dsstox_rid_81863

    16. Dsstox_gsid_46734

    17. Ipidacrine Hydrochloride Hydrate (jan)

    18. Cas-118499-70-0

    19. Unii-ov96aik79q

    20. Schembl6633743

    21. Chembl1898637

    22. Dtxsid9046734

    23. Tox21_112577

    24. Mfcd00517543

    25. Akos015911890

    26. Tox21_112577_1

    27. Ac-7050

    28. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine Hydrochloride Hydrate (1:1:1)

    29. Ncgc00263455-01

    30. As-38638

    31. D09750

    32. Ipidacrine Hydrochloride Monohydrate [mi]

    33. 499i700

    34. A893144

    35. Q27285863

    36. F6170-0023

    37. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-aminehydrochloridehydrate

    38. 2,3,5,6,7,8-hexahydro-1h-cyclopenta(b)quinolin-9-ylamine, Hydrochloride Hydrate

    39. 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine Hydrochloride Hydrate (1

    40. 9-amino-2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinoline Hydrochloride Monohydrate; 2,3,5,6,7,8-hexahydro-1h-cyclopenta[b]quinolin-9-amine Hydrochloride Hydrate (1:1:1)

    2.4 Create Date
    2006-07-28
    3 Chemical and Physical Properties
    Molecular Weight 242.74 g/mol
    Molecular Formula C12H19ClN2O
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass242.1185909 g/mol
    Monoisotopic Mass242.1185909 g/mol
    Topological Polar Surface Area39.9 Ų
    Heavy Atom Count16
    Formal Charge0
    Complexity216
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3