N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide

C12H23N3O3S — CID 115752221

IUPACN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide
SMILESCN(CC(=O)N1CCNCC1)S(=O)(=O)C1CCCC1
InChIInChI=1S/C12H23N3O3S/c1-14(19(17,18)11-4-2-3-5-11)10-12(16)15-8-6-13-7-9-15/h11,13H,2-10H2,1H3
InChIKeyPYTVBWIESHTJRQ-UHFFFAOYSA-N
MW289.40 g/mol
LogP-0.38
Rot. Bonds4

About N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide

N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide (PubChem CID 115752221) has the molecular formula C12H23N3O3S and a molecular weight of 289.40 g/mol. Its IUPAC name is N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide
PubChem CID115752221
Molecular FormulaC12H23N3O3S
Molecular Weight289.40 g/mol
Exact Mass289.15
IUPAC NameN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide
SMILESCN(CC(=O)N1CCNCC1)S(=O)(=O)C1CCCC1
InChIInChI=1S/C12H23N3O3S/c1-14(19(17,18)11-4-2-3-5-11)10-12(16)15-8-6-13-7-9-15/h11,13H,2-10H2,1H3
InChIKeyPYTVBWIESHTJRQ-UHFFFAOYSA-N
XLogP-0.38
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)pyrrolidine-3-sulfonamide
CID 65421585
N,4-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)piperidine-1-sulfonamide;hydrochloride
CID 119967604
N,3-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)piperidine-1-sulfonamide
CID 43602810
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexanecarboxamide
CID 43603207
2-(dimethylamino)-1-piperazin-1-ylethanone
CID 16770302
1-[2-[[cyclohexyl(methyl)sulfamoyl]amino]acetyl]piperazine
CID 60894938
2-[methyl(propan-2-yl)amino]-1-piperazin-1-ylethanone
CID 24701593
2-[methyl(oxan-4-yl)amino]-1-piperazin-1-ylethanone
CID 43611217
2-cyclopentylsulfonyl-1-(1,4-diazepan-1-yl)ethanone;hydrochloride
CID 119414901
2-[methyl(spiro[4.5]decan-8-yl)amino]-1-piperazin-1-ylethanone
CID 114818797
N-methyl-1-(5-methyl-1,2-oxazol-3-yl)-N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
CID 61019091
3-[cyclopentyl(methyl)amino]-1-piperazin-1-ylpropan-1-one
CID 62543081

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide?
The IUPAC name of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide (CID 115752221) is N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide.
What is the SMILES notation for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide?
The canonical SMILES for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide is CN(CC(=O)N1CCNCC1)S(=O)(=O)C1CCCC1.
What is the InChIKey of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide?
The InChIKey is PYTVBWIESHTJRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3S/c1-14(19(17,18)11-4-2-3-5-11)10-12(16)15-8-6-13-7-9-15/h11,13H,2-10H2,1H3.
What are the key properties of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide?
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide has a molecular weight of 289.40 g/mol, XLogP of -0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide is sourced from PubChem (CID 115752221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).