1 2D Structure

2D Structure

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 Formula	C₅H₁₀N₂O
Molecular Weight	114.15 g/mol
XLogP3	-0.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	41.1
Heavy Atom Count	8
Formal Charge	0
Complexity	103
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

922178-61-8