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    SPRIO Imidazole HCl

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 151257-01-1, 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one hydrochloride, 2-butyl-1,3-diaza-spiro[4.4]non-1-en-4-one hcl, 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one;hydrochloride, 1,3-diazaspiro[4.4]non-1-en-4-one, 2-butyl-, monohydrochloride, Mfcd03428357
    Molecular Formula
    C11H19ClN2O
    Molecular Weight
    230.73  g/mol
    InChI Key
    WWRHZLCKSVQRBG-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one;hydrochloride
    2.1.2 InChI
    InChI=1S/C11H18N2O.ClH/c1-2-3-6-9-12-10(14)11(13-9)7-4-5-8-11;/h2-8H2,1H3,(H,12,13,14);1H
    2.1.3 InChI Key
    WWRHZLCKSVQRBG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCCC1=NC2(CCCC2)C(=O)N1.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 151257-01-1

    2. 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one Hydrochloride

    3. 2-butyl-1,3-diaza-spiro[4.4]non-1-en-4-one Hcl

    4. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one;hydrochloride

    5. 1,3-diazaspiro[4.4]non-1-en-4-one, 2-butyl-, Monohydrochloride

    6. Mfcd03428357

    7. 2-butyl-1,3-diazaspiro(4.4)non-1-en-4-one Hydrochloride

    8. 2-butyl-4-spirocyclopentane-2-imidazolin-5-one, Hcl

    9. 1,3-diazaspiro[4.4]non-1-en-4-one, 2-butyl-, Hydrochloride (1:1)

    10. 2-butyl-4-spirocyclopentane-2-imidazolin-5-one Hydrochloride

    11. 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one Hcl

    12. Ec 424-560-4

    13. Schembl535435

    14. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-onehydrochloride

    15. Dtxsid10436477

    16. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one--hydrogen Chloride (1/1)

    17. Akos015907796

    18. Akos037643283

    19. Ab15412

    20. Ac-6864

    21. Am90294

    22. Cs-w014181

    23. As-12497

    24. Sy036928

    25. B3291

    26. Ft-0659370

    27. 257b011

    28. A809140

    29. 2-butyl-1,3-diazaspiro[4,4]non-1-en-4-one Hcl

    30. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one Hcl

    31. 2n-butyl-1,3-diazaspiro (4,4) Non-1-en-4 One Hcl

    32. 2n-butyl-1,3-diazaspiro (4,4) Non-1-en-4-one Hcl

    33. 2-butyl-1,3-diaza-spiro[4.4]non-1-en-4-one Hydrochloride

    34. 2-butyl-1,3-diaza-spiro[4.4]non-1-en4-one Monohydrochloride

    35. 2-butyl-1,3-diazaspiro[4,4]non-1-en-4-one Monohydrochloride

    36. 2-butyl-1,3-diazaspiro[4.4]non-2-en-4-one Monohydrochloride

    37. 2-(n-butyl)-1,3-diazaspiro[4.4]non-1-ene-4-one Hydrochloride

    38. 2-butyl-1,3-diaza-spiro [4.4] Non-1-en-4-one Monohydrochloride

    39. 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-onehydrochloride

    40. 8-butyl-7,9-diazaspiro[4.4]non-8-en-6-one Hydrochloride;2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one Hcl

    2.3 Create Date
    2006-10-25
    3 Chemical and Physical Properties
    Molecular Weight 230.73 g/mol
    Molecular Formula C11H19ClN2O
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass230.1185909 g/mol
    Monoisotopic Mass230.1185909 g/mol
    Topological Polar Surface Area41.5 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity265
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2