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2D Structure
Also known as: 53617-36-0, 1-methyl-4-(4-piperidinyl)piperazine, 1-methyl-4-(piperidin-4-yl)-piperazine, 1-methyl-4-piperidin-4-yl-piperazine, 1-methyl-4-piperidin-4-ylpiperazine, Piperazine, 1-methyl-4-(4-piperidinyl)-
Molecular Formula
C10H21N3
Molecular Weight
183.29  g/mol
InChI Key
MRYYJGQKVGZGSB-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-methyl-4-piperidin-4-ylpiperazine
2.1.2 InChI
InChI=1S/C10H21N3/c1-12-6-8-13(9-7-12)10-2-4-11-5-3-10/h10-11H,2-9H2,1H3
2.1.3 InChI Key
MRYYJGQKVGZGSB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN1CCN(CC1)C2CCNCC2
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 53617-36-0

2. 1-methyl-4-(4-piperidinyl)piperazine

3. 1-methyl-4-(piperidin-4-yl)-piperazine

4. 1-methyl-4-piperidin-4-yl-piperazine

5. 1-methyl-4-piperidin-4-ylpiperazine

6. Piperazine, 1-methyl-4-(4-piperidinyl)-

7. 99726-99-5

8. Mfcd03274729

9. 1-methyl-4-(4-piperidyl)piperazine

10. 1 Methyl-4-(piperidin-4-yl)piperazine

11. Oprea1_568221

12. Oprea1_801469

13. Schembl383553

14. Dtxsid30912521

15. Bcp13916

16. Cs-m1225

17. 1-methyl-4-piperidin-4yl-piperazine

18. Zinc19504179

19. 1-methyl-4-piperidin-4-yl-piperazin

20. 4-(1-methyl-4-piperazinyl)piperidine

21. 4-(1-methylpiperazin-4-yl)piperidine

22. 4-(4-methyl-1-piperazinyl)piperidine

23. Akos000185755

24. Am85307

25. As-5559

26. Sb17896

27. 1-methyl-4-(piperidine-4-yl)piperazine

28. Ac-30880

29. Bas 04918778

30. Sy032225

31. Db-019256

32. Bb 0261283

33. Ft-0640181

34. 1-methyl-4-(4-piperidyl)piperazine Hydrochoride

35. A817027

36. A829687

37. A851688

38. A1-50272

39. J-504944

40. 1-methyl-4-(piperidin-4-yl)-piperazine, Aldrichcpr

41. 4-(2,5-dioxo-2,5-dihydro-pyrrol-1-yl)-phthalicacid

42. 3-(2-methyl-1-piperidyl)-2-phenyl-propan-1-ol;1-methyl-4-(4-piperidinyl)piperazine

2.3 Create Date
2005-07-08
3 Chemical and Physical Properties
Molecular Weight 183.29 g/mol
Molecular Formula C10H21N3
XLogP30.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass183.173547683 g/mol
Monoisotopic Mass183.173547683 g/mol
Topological Polar Surface Area18.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity146
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1