1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one

C10H17N3O2 — CID 82508282

IUPAC1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one
SMILESCN1CC(C(=O)N2CCNCC2)CC1=O
InChIInChI=1S/C10H17N3O2/c1-12-7-8(6-9(12)14)10(15)13-4-2-11-3-5-13/h8,11H,2-7H2,1H3
InChIKeyUIFQMXOTZKAGHS-UHFFFAOYSA-N
MW211.26 g/mol
LogP-1.10
Rot. Bonds1

About 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one

1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one (PubChem CID 82508282) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one
PubChem CID82508282
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one
SMILESCN1CC(C(=O)N2CCNCC2)CC1=O
InChIInChI=1S/C10H17N3O2/c1-12-7-8(6-9(12)14)10(15)13-4-2-11-3-5-13/h8,11H,2-7H2,1H3
InChIKeyUIFQMXOTZKAGHS-UHFFFAOYSA-N
XLogP-1.10
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-1.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-butyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one
CID 82042052
2-[4-(1-methyl-5-oxopyrrolidine-3-carbonyl)piperazin-1-yl]acetic acid
CID 43521272
1-(3,5-dimethylphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one
CID 174964651
4-(1,4-diazepane-1-carbonyl)-1-[2-(dimethylamino)ethyl]pyrrolidin-2-one
CID 119416484
(4S)-4-(piperazine-1-carbonyl)-1-(2,2,2-trifluoroethyl)pyrrolidin-2-one
CID 124698826
4-[4-(2-hydroxy-2-methylpropyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 63655372
(4R)-4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 94092850
4-(piperazine-1-carbonyl)-1-(2,2,2-trifluoroethyl)pyrrolidin-2-one
CID 119403234
(4R)-4-[4-(benzenesulfonyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 51937420
(4S)-4-[4-(3-chloro-4-pyridinyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 97242543
4-[4-(cyclopropylmethylamino)piperidine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 119623785
1-(2-methylphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one;hydrate;hydrochloride
CID 21128885

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
The IUPAC name of 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one (CID 82508282) is 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
The canonical SMILES for 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one is CN1CC(C(=O)N2CCNCC2)CC1=O.
What is the InChIKey of 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
The InChIKey is UIFQMXOTZKAGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-12-7-8(6-9(12)14)10(15)13-4-2-11-3-5-13/h8,11H,2-7H2,1H3.
What are the key properties of 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one has a molecular weight of 211.26 g/mol, XLogP of -1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(piperazine-1-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 82508282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).