1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-(4-methylpiperazin-1-yl)pyridin-2-amine

2.1.2 InChI

InChI=1S/C10H16N4/c1-13-4-6-14(7-5-13)9-2-3-10(11)12-8-9/h2-3,8H,4-7H2,1H3,(H2,11,12)

2.1.3 InChI Key

QDMPMBFLXOWHRY-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1CCN(CC1)C2=CN=C(C=C2)N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 571189-49-6

2. 1-methyl-4-(6-aminopyridin-3-yl)piperazine

3. 5-(4-methyl-piperazin-1-yl)-pyridin-2-ylamine

4. 2-pyridinamine, 5-(4-methyl-1-piperazinyl)-

5. Mfcd10009563

6. 2-amino-5-(4-methyl-1-piperazinyl)pyridine

7. Schembl521324

8. Chembl4535536

9. Dtxsid80624889

10. Bcp23523

11. Cs-m3136

12. Zinc19868051

13. Akos000222384

14. Fs-2855

15. Sb37720

16. Sy046603

17. 5-(4-methylpiperazin-1-yl)piridin-2-amine

18. Am20070171

19. Bb 0261571

20. Ft-0645603

21. M3176

22. 5-(4-methylpiperazin-1-yl)pyridin-2--amine

23. En300-42675

24. Ab00998603-01

25. J-516269

26. 1-methyl-4-(6-aminopyridin-3-yl)piperazine, Aldrichcpr

27. Z332375272

2.3 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₆N₄
Molecular Weight	192.26 g/mol
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	45.4
Heavy Atom Count	14
Formal Charge	0
Complexity	177
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

1-methyl-4-(6-aminopyridin-3-yl)piperazine

1-methyl-4-(6-aminopyridin-3-yl)piperazine

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