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2D Structure
Also known as: 151257-01-1, 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one hydrochloride, 2-butyl-1,3-diaza-spiro[4.4]non-1-en-4-one hcl, 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one;hydrochloride, 1,3-diazaspiro[4.4]non-1-en-4-one, 2-butyl-, monohydrochloride, Mfcd03428357
Molecular Formula
C11H19ClN2O
Molecular Weight
230.73  g/mol
InChI Key
WWRHZLCKSVQRBG-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one;hydrochloride
2.1.2 InChI
InChI=1S/C11H18N2O.ClH/c1-2-3-6-9-12-10(14)11(13-9)7-4-5-8-11;/h2-8H2,1H3,(H,12,13,14);1H
2.1.3 InChI Key
WWRHZLCKSVQRBG-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCCCC1=NC2(CCCC2)C(=O)N1.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 151257-01-1

2. 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one Hydrochloride

3. 2-butyl-1,3-diaza-spiro[4.4]non-1-en-4-one Hcl

4. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one;hydrochloride

5. 1,3-diazaspiro[4.4]non-1-en-4-one, 2-butyl-, Monohydrochloride

6. Mfcd03428357

7. 2-butyl-1,3-diazaspiro(4.4)non-1-en-4-one Hydrochloride

8. 2-butyl-4-spirocyclopentane-2-imidazolin-5-one, Hcl

9. 1,3-diazaspiro[4.4]non-1-en-4-one, 2-butyl-, Hydrochloride (1:1)

10. 2-butyl-4-spirocyclopentane-2-imidazolin-5-one Hydrochloride

11. 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one Hcl

12. Ec 424-560-4

13. Schembl535435

14. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-onehydrochloride

15. Dtxsid10436477

16. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one--hydrogen Chloride (1/1)

17. Akos015907796

18. Akos037643283

19. Ab15412

20. Ac-6864

21. Am90294

22. Cs-w014181

23. As-12497

24. Sy036928

25. B3291

26. Ft-0659370

27. 257b011

28. A809140

29. 2-butyl-1,3-diazaspiro[4,4]non-1-en-4-one Hcl

30. 2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one Hcl

31. 2n-butyl-1,3-diazaspiro (4,4) Non-1-en-4 One Hcl

32. 2n-butyl-1,3-diazaspiro (4,4) Non-1-en-4-one Hcl

33. 2-butyl-1,3-diaza-spiro[4.4]non-1-en-4-one Hydrochloride

34. 2-butyl-1,3-diaza-spiro[4.4]non-1-en4-one Monohydrochloride

35. 2-butyl-1,3-diazaspiro[4,4]non-1-en-4-one Monohydrochloride

36. 2-butyl-1,3-diazaspiro[4.4]non-2-en-4-one Monohydrochloride

37. 2-(n-butyl)-1,3-diazaspiro[4.4]non-1-ene-4-one Hydrochloride

38. 2-butyl-1,3-diaza-spiro [4.4] Non-1-en-4-one Monohydrochloride

39. 2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-onehydrochloride

40. 8-butyl-7,9-diazaspiro[4.4]non-8-en-6-one Hydrochloride;2-n-butyl-1,3-diaza-spiro[4,4]non-1-en-4-one Hcl

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 230.73 g/mol
Molecular Formula C11H19ClN2O
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass230.1185909 g/mol
Monoisotopic Mass230.1185909 g/mol
Topological Polar Surface Area41.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity265
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2