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Also known as: 6928-85-4, 4-methylpiperazin-1-amine, 1-piperazinamine, 4-methyl-, 4-methyl-1-piperazinamine, 4-methyl-piperazin-1-ylamine, 1-methyl-4-aminopiperazine
Molecular Formula
C5H13N3
Molecular Weight
115.18  g/mol
InChI Key
RJWLLQWLBMJCFD-UHFFFAOYSA-N
FDA UNII
J5GBT1LFT2

CAS 6928-85-4
1 2D Structure

CAS 6928-85-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-methylpiperazin-1-amine
2.1.2 InChI
InChI=1S/C5H13N3/c1-7-2-4-8(6)5-3-7/h2-6H2,1H3
2.1.3 InChI Key
RJWLLQWLBMJCFD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN1CCN(CC1)N
2.2 Other Identifiers
2.2.1 UNII
J5GBT1LFT2
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 1-amino 4-methylpiperazine

2.3.2 Depositor-Supplied Synonyms

1. 6928-85-4

2. 4-methylpiperazin-1-amine

3. 1-piperazinamine, 4-methyl-

4. 4-methyl-1-piperazinamine

5. 4-methyl-piperazin-1-ylamine

6. 1-methyl-4-aminopiperazine

7. 4-amino-1-methylpiperazine

8. J5gbt1lft2

9. 1-methyl-4-aminopierazine

10. 4-methyl-1-aminopiperazine

11. N-amino-n'-methylpiperazine

12. N1-methyl-n4-aminopiperazine

13. (4-methylpiperazin-1-yl)amine

14. Nsc-80649

15. Nsc80649

16. Einecs 230-053-7

17. Nsc 80649

18. Unii-j5gbt1lft2

19. N-amino-4-methylpiperazine

20. 1-amino 4-methylpiperazine

21. 4-methylpiperazin-1-ylamine

22. N-methyl-n'-aminopiperazine

23. Dsstox_cid_31597

24. Dsstox_rid_97481

25. 1-amino-4-methyl Piperazine

26. 4-methyl-1-amino Piperazine

27. Dsstox_gsid_57808

28. Schembl65054

29. 1-amino-4-methyl-piperazine

30. N-amino-n'-methyl Piperazine

31. 4-methyl-1-piperazinamine #

32. Chembl3560514

33. Dtxsid3057808

34. 1-amino-4-methylpiperazine, 97%

35. Bcp22015

36. Tox21_113841

37. Bbl027562

38. Mfcd00006154

39. Stl281176

40. Zinc19167247

41. Akos000118812

42. Am85350

43. Piperazine, 1-amino-4-methyl-

44. Ncgc00253722-01

45. As-58378

46. Cas-6928-85-4

47. Piperazine, 1-hydrazinyl-4-methyl-

48. A1192

49. Cs-0071327

50. Ft-0607330

51. A836419

52. Sr-01000944741

53. Sr-01000944741-1

54. W-104639

55. F2190-0525

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 115.18 g/mol
Molecular Formula C5H13N3
XLogP3-1.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass115.110947427 g/mol
Monoisotopic Mass115.110947427 g/mol
Topological Polar Surface Area32.5 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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