4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride

C10H18ClN3O2 — CID 119473611

IUPAC4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
SMILESCC1CNCCN1C(=O)C1CNC(=O)C1.Cl
InChIInChI=1S/C10H17N3O2.ClH/c1-7-5-11-2-3-13(7)10(15)8-4-9(14)12-6-8;/h7-8,11H,2-6H2,1H3,(H,12,14);1H
InChIKeyDSQOWPXTSWSPNH-UHFFFAOYSA-N
MW247.73 g/mol
LogP-0.64
Rot. Bonds1

About 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride

4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride (PubChem CID 119473611) has the molecular formula C10H18ClN3O2 and a molecular weight of 247.73 g/mol. Its IUPAC name is 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride.

Molecular Properties

Compound Name4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
PubChem CID119473611
Molecular FormulaC10H18ClN3O2
Molecular Weight247.73 g/mol
Exact Mass247.11
IUPAC Name4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
SMILESCC1CNCCN1C(=O)C1CNC(=O)C1.Cl
InChIInChI=1S/C10H17N3O2.ClH/c1-7-5-11-2-3-13(7)10(15)8-4-9(14)12-6-8;/h7-8,11H,2-6H2,1H3,(H,12,14);1H
InChIKeyDSQOWPXTSWSPNH-UHFFFAOYSA-N
XLogP-0.64
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2R)-2-methylpiperazine-1-carbonyl]piperidin-2-one
CID 82705832
5-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride
CID 119470987
N-methyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide
CID 83193491
N,N-dimethyl-1-(5-oxopyrrolidine-3-carbonyl)piperazine-2-carboxamide
CID 83191600
(5S)-5-[(2R)-2-methylpiperazine-1-carbonyl]pyrrolidin-2-one
CID 94545844
[(2R)-2-methylpiperazin-1-yl]-(thiolan-3-yl)methanone
CID 82756247
[(1R,2R)-2-methylcyclopropyl]-(2-methylpiperazin-1-yl)methanone
CID 155385369
1-[(2S)-2-methylpiperazin-1-yl]ethanone
CID 54446440
1-[(2R)-2-methylpiperazin-1-yl]ethanone
CID 55300442
(2-methylpiperazin-1-yl)-(1-pyrazin-2-ylpiperidin-4-yl)methanone;dihydrochloride
CID 119473452
6-bicyclo[3.1.0]hexanyl-(2-methylpiperazin-1-yl)methanone;hydrochloride
CID 119470839
1-(2-methylpiperazin-1-yl)propan-1-one
CID 10820824

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
The IUPAC name of 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride (CID 119473611) is 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride.
What is the SMILES notation for 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
The canonical SMILES for 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride is CC1CNCCN1C(=O)C1CNC(=O)C1.Cl.
What is the InChIKey of 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
The InChIKey is DSQOWPXTSWSPNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2.ClH/c1-7-5-11-2-3-13(7)10(15)8-4-9(14)12-6-8;/h7-8,11H,2-6H2,1H3,(H,12,14);1H.
What are the key properties of 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride has a molecular weight of 247.73 g/mol, XLogP of -0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpiperazine-1-carbonyl)pyrrolidin-2-one;hydrochloride is sourced from PubChem (CID 119473611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).