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    Technical details about CAS 139756-02-8, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 139756-02-8

    BUILDING BLOCK

    PharmaCompass
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    2D Structure
    Also known as: 139756-02-8, 4-amino-1-methyl-3-n-propyl-1h-pyrazole-5-carboxamide, 4-amino-2-methyl-5-propylpyrazole-3-carboxamide, 4-amino-1-methyl-3-n-propyl-5-pyrazolecarboxamide, 19756-62-8, 1h-pyrazole-5-carboxamide, 4-amino-1-methyl-3-propyl-
    Molecular Formula
    C8H14N4O
    Molecular Weight
    182.22  g/mol
    InChI Key
    PZMXDLWWQHYXGY-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-amino-2-methyl-5-propylpyrazole-3-carboxamide
    2.1.2 InChI
    InChI=1S/C8H14N4O/c1-3-4-5-6(9)7(8(10)13)12(2)11-5/h3-4,9H2,1-2H3,(H2,10,13)
    2.1.3 InChI Key
    PZMXDLWWQHYXGY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCCC1=NN(C(=C1N)C(=O)N)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 139756-02-8

    2. 4-amino-1-methyl-3-n-propyl-1h-pyrazole-5-carboxamide

    3. 4-amino-2-methyl-5-propylpyrazole-3-carboxamide

    4. 4-amino-1-methyl-3-n-propyl-5-pyrazolecarboxamide

    5. 19756-62-8

    6. 1h-pyrazole-5-carboxamide, 4-amino-1-methyl-3-propyl-

    7. 4-amino-1-methyl-3-propylpyrazole-5-carboxamide

    8. 4-amino-1-methyl-3-propylpyrazole-5-formylamine

    9. 4-amino-1-methyl-3-n-propylpyrazole-5-carboxamide

    10. Mfcd02927682

    11. 1h-pyrazole-5-carboxamide,4-amino-1-methyl-3-n-propyl

    12. 3-n-propyl-4-amino-5-carboxamido-n-methylpyrazole

    13. 4-amino-1-methyl-3-propyl-5-pyrazolecarboxamide

    14. 4-amino-2-methyl-5-propyl-2h-pyrazole-3-carboxylic Acid Amide

    15. Schembl617

    16. Oprea1_583437

    17. 4-amino-2-methyl-5-propyl-2h-pyrazole-3-carboxamide

    18. Chebi:59006

    19. Dtxsid10391592

    20. Zinc168940

    21. Act01783

    22. Albb-021290

    23. Bcp30481

    24. Stl452915

    25. Akos007930274

    26. Cs-w017101

    27. Ac-27030

    28. Sy017665

    29. Ts-00215

    30. Db-012141

    31. Am20080298

    32. Ft-0617433

    33. Ft-0694696

    34. 1-methyl-3-propyl-4-aminopyrazole-5-carboxaimde

    35. 1-methyl-3-propyl-4-aminopyrazole-5-carboxamide

    36. 4-amino-3-propyl-1-methyl-5-pyrazolecarboxamide

    37. 4-amino-1-methyl-3-propyl-pyrazole-5-carboxamide

    38. 756a028

    39. Sr-01000448249

    40. 4-amino-1-methyl-3-propyl-1h-5-pyrazolecarboxamide

    41. J-007313

    42. Q-200426

    43. Sr-01000448249-1

    44. 1-methyl-3-propyl-4-amino-1h-pyrazole-5-carboxamide

    45. 1-methyl-3-propyl4-amino-5-aminocarbonyl-1h-pyrazole

    46. 4-amino-1-methyl-3-propyl-1h-5-pyrazole Carboxamide

    47. Q27126394

    48. 1-methyl-3-propyl-4-amino-5-aminocarbonyl-1h-pyrazole

    49. 4-amino-1-methyl-3-n-propyl-5-pyrazolecarboxamide, 96%

    50. 4-amino-1-methyl-3-n-propyl-1h-pyrazole-5-carboxamide Hcl

    51. 4-amino-2-methyl-3-n-propyl-2h-pyrazole-3-carboxylic Acid Amide

    52. 4-amino-1-methyl-3-propyl-1h-pyrazole-5-carboxamide;4-amino-1-methyl-3-n-propyl-5-pyrazolecarboxamide

    53. Viagra Intermediate;1h-pyrazole-5-carboxamide,4-am;sildenafil Amino Amide Impurity;4-amino-1-methyl-3-n-propyl-5-pyrazoleca;4-amino-1-methyl-3-propyl-5-pyrazolecarboxam;4-amino-1-methyl-3-n-propyprzol

    2.3 Create Date
    2005-09-07
    3 Chemical and Physical Properties
    Molecular Weight 182.22 g/mol
    Molecular Formula C8H14N4O
    XLogP30.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count3
    Exact Mass182.11676108 g/mol
    Monoisotopic Mass182.11676108 g/mol
    Topological Polar Surface Area86.9 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity197
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1