1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one

C12H21N3O3 — CID 124693963

IUPAC1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one
SMILESC[C@@H]1CN(C(=O)CN2CCNCC2=O)C[C@H](C)O1
InChIInChI=1S/C12H21N3O3/c1-9-6-15(7-10(2)18-9)12(17)8-14-4-3-13-5-11(14)16/h9-10,13H,3-8H2,1-2H3/t9-,10+
InChIKeyHWLDMDQFACWHFD-AOOOYVTPSA-N
MW255.32 g/mol
LogP-0.95
Rot. Bonds2

About 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one

1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one (PubChem CID 124693963) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one.

Molecular Properties

Compound Name1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one
PubChem CID124693963
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one
SMILESC[C@@H]1CN(C(=O)CN2CCNCC2=O)C[C@H](C)O1
InChIInChI=1S/C12H21N3O3/c1-9-6-15(7-10(2)18-9)12(17)8-14-4-3-13-5-11(14)16/h9-10,13H,3-8H2,1-2H3/t9-,10+
InChIKeyHWLDMDQFACWHFD-AOOOYVTPSA-N
XLogP-0.95
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-[(3S,5S)-3,5-dimethylpiperazin-1-yl]-2-oxoethyl]piperazin-2-one
CID 124590607
1-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one
CID 62311600
1-[2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one
CID 124693974
N,N-diethyl-2-(2-oxopiperazin-1-yl)acetamide
CID 62311999
N-(2-methylcyclopropyl)-2-(2-oxopiperazin-1-yl)acetamide
CID 119732239
2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-methylamino]-1-piperazin-1-ylethanone
CID 119915244
1-[2-[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one
CID 95145336
2-[azetidin-3-yl(methyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 66187363
tert-butyl 2-(2-oxopiperazin-1-yl)acetate
CID 10584737
1-(2,6-dimethylmorpholin-4-yl)-2-(3-hydroxyazetidin-1-yl)ethanone
CID 63282275
1-[2-[(2S)-2-[(1R)-1-aminoethyl]piperidin-1-yl]-2-oxoethyl]piperazin-2-one
CID 124688615
1-[2-[2-(2-fluorophenyl)-4-methylpyrrolidin-1-yl]-2-oxoethyl]piperazin-2-one;hydrochloride
CID 122148268

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one?
The IUPAC name of 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one (CID 124693963) is 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one.
What is the SMILES notation for 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one?
The canonical SMILES for 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one is C[C@@H]1CN(C(=O)CN2CCNCC2=O)C[C@H](C)O1.
What is the InChIKey of 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one?
The InChIKey is HWLDMDQFACWHFD-AOOOYVTPSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-9-6-15(7-10(2)18-9)12(17)8-14-4-3-13-5-11(14)16/h9-10,13H,3-8H2,1-2H3/t9-,10+.
What are the key properties of 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one?
1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one has a molecular weight of 255.32 g/mol, XLogP of -0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-2-one is sourced from PubChem (CID 124693963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).