CAS 59878-57-8

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4 End Use APIs
25 Related Intermediates

Chemistry

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Also known as: 59878-57-8, Cyclopropyl(piperazin-1-yl)methanone, 1-cyclopropanecarbonylpiperazine, Cyclopropyl-piperazin-1-yl-methanone, Mfcd06369645, Piperazine, 1-(cyclopropylcarbonyl)-

Molecular Formula

C₈H₁₄N₂O

Molecular Weight

154.21 g/mol

InChI Key

KIALFUYSJAAJSU-UHFFFAOYSA-N

1 2D Structure

CAS 59878-57-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

cyclopropyl(piperazin-1-yl)methanone

2.1.2 InChI

InChI=1S/C8H14N2O/c11-8(7-1-2-7)10-5-3-9-4-6-10/h7,9H,1-6H2

2.1.3 InChI Key

KIALFUYSJAAJSU-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CC1C(=O)N2CCNCC2

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 59878-57-8

2. Cyclopropyl(piperazin-1-yl)methanone

3. 1-cyclopropanecarbonylpiperazine

4. Cyclopropyl-piperazin-1-yl-methanone

5. Mfcd06369645

6. Piperazine, 1-(cyclopropylcarbonyl)-

7. 1-cyclopropylcarbonylpiperazine

8. Chembl3329525

9. 1-(cyclopropanecarbonyl)piperazine

10. Cyclopropyl(1-piperazinyl)methanone

11. 1-(cyclopropanecarbonyl)piperazine 97

12. Piperazinocyclopropyl Ketone

13. Schembl8314

14. 4-cyclopropanecarbonyl-piperazine

15. N-(cyclopropylcarbonyl)piperazine

16. Amy5265

17. Dtxsid30975277

18. Cyclopropyl-1-piperazinylmethanone

19. 1-(cyclopropylcarbonyl)-piperazine

20. N-(cyclopropanecarbonyl) Piperazine

21. Bcp12310

22. Cs-d0807

23. Zinc2586030

24. Bdbm50498042

25. Stl069457

26. Akos000117623

27. Ac-2763

28. Fs-2420

29. Sb17768

30. 1-(cyclopropylcarbonyl)piperazine, 97%

31. Sy002853

32. Ft-0694927

33. A847182

34. J-503541

2.3 Create Date

2005-07-14

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₄N₂O
Molecular Weight	154.21 g/mol
XLogP3	-0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	154.110613074 g/mol
Monoisotopic Mass	154.110613074 g/mol
Topological Polar Surface Area	32.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	160
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