(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one

C10H17N3O2 — CID 94545844

IUPAC(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one
SMILESC[C@@H]1CNCCN1C(=O)[C@@H]1CCC(=O)N1
InChIInChI=1S/C10H17N3O2/c1-7-6-11-4-5-13(7)10(15)8-2-3-9(14)12-8/h7-8,11H,2-6H2,1H3,(H,12,14)/t7-,8+/m1/s1
InChIKeyDJPTZHJTJYOVBO-SFYZADRCSA-N
MW211.26 g/mol
LogP-0.91
Rot. Bonds1

About (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one

(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one (PubChem CID 94545844) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one
PubChem CID94545844
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one
SMILESC[C@@H]1CNCCN1C(=O)[C@@H]1CCC(=O)N1
InChIInChI=1S/C10H17N3O2/c1-7-6-11-4-5-13(7)10(15)8-2-3-9(14)12-8/h7-8,11H,2-6H2,1H3,(H,12,14)/t7-,8+/m1/s1
InChIKeyDJPTZHJTJYOVBO-SFYZADRCSA-N
XLogP-0.91
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-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

5-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
CID 119470987
5-[(2R)-2-methylpiperazine-1-carbonyl]piperidin-2-one
CID 82705832
5-[2-(2-methoxyphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 120733049
4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
CID 119473611
[(1R,2R)-2-methylcyclopropyl]-(2-methylpiperazin-1-yl)methanone
CID 155385369
7-bicyclo[4.1.0]heptanyl-[(2S)-2-methylpiperazin-1-yl]methanone
CID 82704835
1-[(2R)-2-methylpiperazin-1-yl]ethanone
CID 55300442
1-[(2S)-2-methylpiperazin-1-yl]ethanone
CID 54446440
6-bicyclo[3.1.0]hexanyl-(2-methylpiperazin-1-yl)methanone;hydrochloride
CID 119470839
5-(2,5-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one
CID 110744411
(5R)-5-[2-(hydroxymethyl)-3-methylpyrrolidine-1-carbonyl]pyrrolidin-2-one
CID 102737963
(2-cyclopropylcyclopropyl)-(2-methylpiperazin-1-yl)methanone
CID 119473712

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one?
The IUPAC name of (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one (CID 94545844) is (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one?
The canonical SMILES for (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one is C[C@@H]1CNCCN1C(=O)[C@@H]1CCC(=O)N1.
What is the InChIKey of (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one?
The InChIKey is DJPTZHJTJYOVBO-SFYZADRCSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-7-6-11-4-5-13(7)10(15)8-2-3-9(14)12-8/h7-8,11H,2-6H2,1H3,(H,12,14)/t7-,8+/m1/s1.
What are the key properties of (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one?
(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one has a molecular weight of 211.26 g/mol, XLogP of -0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 94545844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).