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    Ciramadol

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    Xls

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    2D Structure
    Also known as: Ciramadol hcl, Ciradol, Ciramadol hydrochloride [usan], 63323-46-6, Wy-15,705 hcl, 090xo8449j
    Molecular Formula
    C15H24ClNO2
    Molecular Weight
    285.81  g/mol
    InChI Key
    XBNIHQOJYIOGEU-HWKASLJMSA-N
    FDA UNII
    090XO8449J
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-[(R)-dimethylamino-[(1R,2R)-2-hydroxycyclohexyl]methyl]phenol;hydrochloride
    2.1.2 InChI
    InChI=1S/C15H23NO2.ClH/c1-16(2)15(11-6-5-7-12(17)10-11)13-8-3-4-9-14(13)18;/h5-7,10,13-15,17-18H,3-4,8-9H2,1-2H3;1H/t13-,14+,15-;/m0./s1
    2.1.3 InChI Key
    XBNIHQOJYIOGEU-HWKASLJMSA-N
    2.1.4 Canonical SMILES
    CN(C)C(C1CCCCC1O)C2=CC(=CC=C2)O.Cl
    2.1.5 Isomeric SMILES
    CN(C)[C@H]([C@H]1CCCC[C@H]1O)C2=CC(=CC=C2)O.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    090XO8449J
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-cis-2-(alpha-dimethylamino-m-hydroxybenzyl)cyclohexanol.hcl

    2. Ciramadol

    3. Ciramadol, (1r-1alpha(r*),2alpha)-isomer

    4. Phenol, 3-((dimethylamino)(2-hydroxycyclohexyl)methyl)-, Hydrochloride, (1alpha(r*),2alpha)-(-)-

    5. Wy-15,705

    2.3.2 Depositor-Supplied Synonyms

    1. Ciramadol Hcl

    2. Ciradol

    3. Ciramadol Hydrochloride [usan]

    4. 63323-46-6

    5. Wy-15,705 Hcl

    6. 090xo8449j

    7. Ciramadol Hydrochloride (usan)

    8. 3-[(r)-dimethylamino-[(1r,2r)-2-hydroxycyclohexyl]methyl]phenol;hydrochloride

    9. Wy 15705 Hydrochloride

    10. Unii-090xo8449j

    11. Einecs 264-099-4

    12. Schembl121279

    13. Chembl2104041

    14. Dtxsid40979443

    15. Wy-15705 Hydrochloride

    16. Wy-15,705 Hydrochloride

    17. Ciramadol Hydrochloride [mi]

    18. (-)-(1r,2r)-2-((r)-alpha-(dimethylamino)-m-hydroxybenzyl)cyclohexanol Hydrochloride

    19. D03524

    20. Q27236440

    21. 3-[(dimethylamino)(2-hydroxycyclohexyl)methyl]phenol--hydrogen Chloride (1/1)

    22. (-)-(1r,2r)-2-((r)-.alpha.-(dimethylamino)-m-hydroxybenzyl)cyclohexanol Hydrochloride

    23. (1r-(1alpha(r*),2alpha)-(3-hydroxy-(alpha-(2-hydroxycyclohexyl)benzyl)dimethylammonium Chloride

    24. Phenol, 3-((dimethylamino)(2-hydroxycyclohexyl)methyl)-, Hydrochloride, (1r-(1.alpha.(r*),2.alpha.))- (-)-

    25. Phenol, 3-((dimethylamino)(2-hydroxycyclohexyl)methyl)-, Hydrochloride, (1r-(1alpha(r*),2alpha))- (-)-

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 285.81 g/mol
    Molecular Formula C15H24ClNO2
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count3
    Exact Mass285.1495567 g/mol
    Monoisotopic Mass285.1495567 g/mol
    Topological Polar Surface Area43.7 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity257
    Isotope Atom Count0
    Defined Atom Stereocenter Count3
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Analgesics

    Compounds capable of relieving pain without the loss of CONSCIOUSNESS. (See all compounds classified as Analgesics.)