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    CAS 18978-78-4

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 18978-78-4, 2-methylquinolin-8-amine, 8-amino-2-methylquinoline, 2-methyl-8-aminoquinoline, 8-quinolinamine, 2-methyl-, 2-methyl-quinolin-8-ylamine
    Molecular Formula
    C10H10N2
    Molecular Weight
    158.20  g/mol
    InChI Key
    JHIAOWGCGNMQKA-UHFFFAOYSA-N
    FDA UNII
    B50L4NE5JU
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-methylquinolin-8-amine
    2.1.2 InChI
    InChI=1S/C10H10N2/c1-7-5-6-8-3-2-4-9(11)10(8)12-7/h2-6H,11H2,1H3
    2.1.3 InChI Key
    JHIAOWGCGNMQKA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=NC2=C(C=CC=C2N)C=C1
    2.2 Other Identifiers
    2.2.1 UNII
    B50L4NE5JU
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 18978-78-4

    2. 2-methylquinolin-8-amine

    3. 8-amino-2-methylquinoline

    4. 2-methyl-8-aminoquinoline

    5. 8-quinolinamine, 2-methyl-

    6. 2-methyl-quinolin-8-ylamine

    7. B50l4ne5ju

    8. Nsc-7944

    9. Mfcd00023998

    10. 8-amino2-methylquinoline

    11. Unii-b50l4ne5ju

    12. 2-methyl-8-quinolinamine

    13. Ec 606-190-7

    14. 2-methylquinolin-8-ylamine

    15. 2-methyl-8-quinolinamine #

    16. Mls000718875

    17. Quinaldine, 8-amino-

    18. Schembl230460

    19. Chembl1717263

    20. (2-methyl-quinolin-8-yl)-amine

    21. Dtxsid60172398

    22. Nsc7944

    23. 2-methyl-8-quinolineamine

    24. Chebi:107285

    25. Hms2722n08

    26. Act10321

    27. Albb-027739

    28. Bcp21670

    29. Nsc 7944

    30. Stk344853

    31. Zinc11535697

    32. (2-methylquinolin-8-yl)amine

    33. 2-methyl-8-quinolinamine, Aldrichcpr

    34. Akos000111125

    35. Ac-7837

    36. Cs-w002143

    37. Sb67541

    38. Ncgc00245426-01

    39. As-13472

    40. Smr000291143

    41. Sy020984

    42. 4-phenyl-2-thiophenecarboxaldehyde96

    43. A0416

    44. Am20070095

    45. Bb 0221198

    46. Ft-0621494

    47. En300-66741

    48. Mls-0251461.0001

    49. 10.14272/jhiaowgcgnmqka-uhfffaoysa-n.1

    50. 978a784

    51. A813357

    52. Doi:10.14272/jhiaowgcgnmqka-uhfffaoysa-n.1

    53. J-519364

    54. Q27185507

    55. F1716-0336

    56. Z111808714

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 158.20 g/mol
    Molecular Formula C10H10N2
    XLogP32
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass158.084398327 g/mol
    Monoisotopic Mass158.084398327 g/mol
    Topological Polar Surface Area38.9 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity158
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1