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    CAS-6640-24-0

    BUILDING BLOCK

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    2D Structure
    Also known as: 6640-24-0, M-chlorophenylpiperazine, 3-chlorophenyl piperazine, M-cpp, 1-(m-chlorophenyl)piperazine, 3-chlorophenylpiperazine
    Molecular Formula
    C10H13ClN2
    Molecular Weight
    196.67  g/mol
    InChI Key
    VHFVKMTVMIZMIK-UHFFFAOYSA-N
    FDA UNII
    REY0CNO998
    m-Chlorophenylpiperazine has been used in trials studying the treatment of Alcoholism.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(3-chlorophenyl)piperazine
    2.1.2 InChI
    InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2
    2.1.3 InChI Key
    VHFVKMTVMIZMIK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CN(CCN1)C2=CC(=CC=C2)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    REY0CNO998
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-(3-chlorophenyl)piperazine Dihydrochloride

    2. 1-(3-chlorophenyl)piperazine Monohydrochloride

    3. 1-(m-chlorophenyl)piperazine

    4. 1-3-cpp

    5. 3-chlorophenylpiperazine

    6. Dihydrochloro Phenyl Piperazine

    7. M-chlorophenylpiperazine

    8. M-cpp

    9. Meta-chlorophenylpiperazine

    2.3.2 Depositor-Supplied Synonyms

    1. 6640-24-0

    2. M-chlorophenylpiperazine

    3. 3-chlorophenyl Piperazine

    4. M-cpp

    5. 1-(m-chlorophenyl)piperazine

    6. 3-chlorophenylpiperazine

    7. 1-(3-chlorophenyl) Piperazine

    8. Piperazine, (3-chlorophenyl)-

    9. Chembl478

    10. Rey0cno998

    11. 1-(3-chlorophenyl)-piperazine (m-cpp)

    12. Chebi:10588

    13. Nsc-49307

    14. Ncgc00015247-04

    15. Dsstox_cid_25138

    16. Dsstox_rid_80696

    17. Dsstox_gsid_45138

    18. Meta-chlorophenylpiperazine

    19. Nsc 49307

    20. Cas-6640-24-0

    21. 1-(3-chlorophenyl)-piperazine

    22. 1-(3-chlorophenyl)piperazinehydrochloride

    23. Einecs 229-654-7

    24. Unii-rey0cno998

    25. Meta Chlorophenyl Piperazine

    26. N-(3-chlorophenyl)piperazine

    27. 4-(3-chlorophenyl)piperazine

    28. 1-(3-chloro Phenyl)piperazine

    29. Piperazine, 1-(3-chlorophenyl)-

    30. Tocris-0875

    31. 3cpp

    32. Lopac-c-5554

    33. (m-cpp)

    34. Biomol-nt_000129

    35. Ec 229-654-7

    36. Meta-chlorophenyl-piperazine

    37. (3-chlorophenyl)-piperazine

    38. Lopac0_000245

    39. Schembl48931

    40. 4-(m-chlorophenyl)piperazine

    41. Gtpl142

    42. (3-chloro-phenyl)-piperazine

    43. N-(m-chlorophenyl)-piperazine

    44. 4-(3-chlorophenyl)-piperazine

    45. Bpbio1_000067

    46. Zinc4285

    47. Dtxsid9045138

    48. 1-(3-chloro-phenyl)-piperazine

    49. M-chlorophenylpiperazine (m-cpp)

    50. Piperazine, 1-(m-chlorophenyl)-

    51. Albb-005970

    52. Bcp15052

    53. Cs-d0555

    54. Nsc49307

    55. Tox21_110110

    56. Bdbm50001915

    57. Pdsp1_000002

    58. Pdsp2_000002

    59. Stk397316

    60. Akos000101295

    61. Tox21_110110_1

    62. 1-m-chlorophenyl Piperazine Metabolite

    63. Ccg-204340

    64. Db12110

    65. Gf-0110

    66. Ncgc00015247-01

    67. Ncgc00015247-02

    68. Ncgc00015247-03

    69. Ncgc00015247-05

    70. Ncgc00015247-07

    71. Ncgc00024836-01

    72. Ncgc00024836-02

    73. Ncgc00024836-03

    74. Ac-23379

    75. Db-024578

    76. J227.960f

    77. A8960

    78. Bb 0254666

    79. Aj-333/09217060

    80. L000009

    81. Q286112

    82. W-104754

    83. Brd-k75844781-001-01-9

    84. Brd-k75844781-003-03-1

    85. 1-(m-chlorophenyl)piperazine; 4-(3-chlorophenyl)piperazine; N-(3-chlorophenyl)piperazine; N-(m-chlorophenyl)piperazine

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 196.67 g/mol
    Molecular Formula C10H13ClN2
    XLogP31.7
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count1
    Exact Mass196.0767261 g/mol
    Monoisotopic Mass196.0767261 g/mol
    Topological Polar Surface Area15.3 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity157
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Serotonin Receptor Agonists

    Endogenous compounds and drugs that bind to and activate SEROTONIN RECEPTORS. Many serotonin receptor agonists are used as ANTIDEPRESSANTS; ANXIOLYTICS; and in the treatment of MIGRAINE DISORDERS. (See all compounds classified as Serotonin Receptor Agonists.)

    4.2 Metabolism/Metabolites

    1-(3-Chlorophenyl)piperazine has known human metabolites that include 2-chloro-4-(piperazin-1-yl)phenol.

    1-(3-Chlorophenyl)piperazine is a known human metabolite of etoperidone, nefazodone, and trazodone.

    S73 | METXBIODB | Metabolite Reaction Database from BioTransformer | DOI:10.5281/zenodo.4056560