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    Methenamine Mandelate

    ACTIVE PHARMA INGREDIENTS

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    2D Structure
    Also known as: 587-23-5, Hexydaline, Hexamethylenetetramine mandelate, Mandacon, Hexamine mandelate, Hexamethylenamine mandelate
    Molecular Formula
    C14H20N4O3
    Molecular Weight
    292.33  g/mol
    InChI Key
    UXNFIJPHRQEWRQ-UHFFFAOYSA-N
    FDA UNII
    695N30CINR
    Methenamine Mandelate is an organic salt containing a one to one ratio of methenamine, a heterocyclic organic compound, and mandelic acid, an aromatic alpha hydroxy acid, used in the treatment of urinary tract infections.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-hydroxy-2-phenylacetic acid;1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane
    2.1.2 InChI
    InChI=1S/C8H8O3.C6H12N4/c9-7(8(10)11)6-4-2-1-3-5-6;1-7-2-9-4-8(1)5-10(3-7)6-9/h1-5,7,9H,(H,10,11);1-6H2
    2.1.3 InChI Key
    UXNFIJPHRQEWRQ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1N2CN3CN1CN(C2)C3.C1=CC=C(C=C1)C(C(=O)O)O
    2.2 Other Identifiers
    2.2.1 UNII
    695N30CINR
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Mandelamine

    2.3.2 Depositor-Supplied Synonyms

    1. 587-23-5

    2. Hexydaline

    3. Hexamethylenetetramine Mandelate

    4. Mandacon

    5. Hexamine Mandelate

    6. Hexamethylenamine Mandelate

    7. Methenamine Mandelate [usp]

    8. 695n30cinr

    9. Hexamine Mandelate (jan)

    10. 1,3,5,7-tetraazatricyclo(3.3.1.1(3,7))decane, Mono(alpha-hydroxybenzeneacetate)

    11. Methenamine Mandelate (usp)

    12. Hexamine Mandelate [jan]

    13. Mantropine

    14. Uromandelin

    15. Cedulamin

    16. Diuramine

    17. Mandalay

    18. Mandastat

    19. Mandopan

    20. Mandural

    21. Mandurin

    22. Penelate

    23. Renelate

    24. Uronamin

    25. Uronamine

    26. Mandoz

    27. Reflux

    28. Uro-cedulamin

    29. Prov-u-sep

    30. Hexamethyleneamine Mandelate

    31. Unii-695n30cinr

    32. Mandelic Acid Methenamine Salt

    33. Hexamethylenetetramine, Mandelate

    34. Hexamethylenetetramine Monomandelate

    35. Mandelamine (tn)

    36. Einecs 209-597-4

    37. Einecs 229-817-2

    38. Mandelic Acid Salt With (ch2)6n4

    39. Hexamethylenetetramine Phenylglycolate

    40. Ai3-50130

    41. Methenaminemandelate

    42. Schembl3645

    43. Mandelic Acid, Compd With Hexamethylenetetramine

    44. Chembl3833312

    45. Mandelic Acid, Compd. With Hexamethylenetetramine (1:1)

    46. Dtxsid40941180

    47. Methenamine Mandelate [mi]

    48. Bcp32164

    49. Mandelate, Hexamethylenetetra-amine-

    50. Methenamine Mandelate [vandf]

    51. Methenamine Mandelate [mart.]

    52. 2-hydroxy-2-phenylacetic Acid;1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane

    53. Akos024319335

    54. Methenamine Mandelate [usp-rs]

    55. Methenamine Mandelate [who-dd]

    56. 6754-75-2

    57. Methenamine Mandelate [green Book]

    58. Hexamethylenetetramine Mono-(+-)-mandelate

    59. Db-053249

    60. Ft-0603481

    61. Methenamine Mandelate [usp Monograph]

    62. D00856

    63. Hexamethylenetetramine Mono-(+/-)-mandelate

    64. Q27264316

    65. Hexamethylenetetramine Mandelate Pound>>hexamine Mandelate

    66. Glycolic Acid, Compound With 1,3,5,7-tetraazatricyclo(3.3.1.13,7)decane

    67. Methenamine Mandelate, United States Pharmacopeia (usp) Reference Standard

    68. Hydroxy(phenyl)acetic Acid--1,3,5,7-tetraazatricyclo[3.3.1.1~3,7~]decane (1/1)

    69. 19442-87-6

    70. Benzeneacetic Acid, .alpha.-hydroxy-, (+/-)-, Compd. With 1,3,5,7-tetraazatricyclo((3.3.1.1(sup 3,7))decane (1:1)

    71. Benzeneacetic Acid, Alpha-hydroxy-, (+-)-, Compd. With 1,3,5,7-tetraazatricyclo(3.3.1.1(sup 3,7))decane (1:1)

    72. Benzeneacetic Acid, Alpha-hydroxy-, Compd With 1,3,5,7-tetraazatricyclo(3.3.1.1(3,7))decane

    73. Benzeneacetic Acid, Alpha-hydroxy-, Compd. With 1,3,5,7-tetraazatricyclo(3.3.1.1(3,7))decane (1:1)

    74. Hydroxy(phenyl)acetic Acid Compound With 1,3,5,7-tetraazatricyclo[3.3.1.1~3,7~]decane (1:1)

    2.4 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 292.33 g/mol
    Molecular Formula C14H20N4O3
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count2
    Exact Mass292.15354051 g/mol
    Monoisotopic Mass292.15354051 g/mol
    Topological Polar Surface Area70.5 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity223
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Anti-Bacterial Agents

    Substances that inhibit the growth or reproduction of BACTERIA. (See all compounds classified as Anti-Bacterial Agents.)