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Also known as: 922178-61-8, Dtxsid90584107, Dtxcid20534872, 693-438-2, (r)-3-methylpiperazin-2-one, (r)-3-methyl-2-ketopiperazine
Molecular Formula
C5H10N2O
Molecular Weight
114.15  g/mol
InChI Key
BSPUWRUTIOUGMZ-SCSAIBSYSA-N

922178-61-8
1 2D Structure

922178-61-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(3R)-3-methylpiperazin-2-one
2.1.2 InChI
InChI=1S/C5H10N2O/c1-4-5(8)7-3-2-6-4/h4,6H,2-3H2,1H3,(H,7,8)/t4-/m1/s1
2.1.3 InChI Key
BSPUWRUTIOUGMZ-SCSAIBSYSA-N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 922178-61-8

2. Dtxsid90584107

3. Dtxcid20534872

4. 693-438-2

5. (r)-3-methylpiperazin-2-one

6. (r)-3-methyl-2-ketopiperazine

7. (r)-3-methyl-piperazin-2-one

8. (r)-3-methyl-2-oxo-piperazine

9. Mfcd07373460

10. (3r)-3-methyl-2-piperazinone

11. Schembl323859

12. Bspuwrutiougmz-scsaibsysa-n

13. Akos006349272

14. Ds-3981

15. Ac-29442

16. Db-336237

17. Cs-0042202

18. (r)-3-methyl-2-ketopiperazine, >=99.0% (gc)

2.3 Create Date
2007-07-12
3 Chemical and Physical Properties
Molecular Weight 114.15 g/mol
Molecular Formula C5H10N2O
XLogP3-0.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area41.1
Heavy Atom Count8
Formal Charge0
Complexity103
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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