2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide

C9H17N3O4S — CID 82182498

IUPAC2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide
SMILESNC(=O)CS(=O)(=O)CCC(=O)N1CCNCC1
InChIInChI=1S/C9H17N3O4S/c10-8(13)7-17(15,16)6-1-9(14)12-4-2-11-3-5-12/h11H,1-7H2,(H2,10,13)
InChIKeyXDPZVIPICMPKIS-UHFFFAOYSA-N
MW263.32 g/mol
LogP-2.29
Rot. Bonds5

About 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide

2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide (PubChem CID 82182498) has the molecular formula C9H17N3O4S and a molecular weight of 263.32 g/mol. Its IUPAC name is 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide.

Molecular Properties

Compound Name2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide
PubChem CID82182498
Molecular FormulaC9H17N3O4S
Molecular Weight263.32 g/mol
Exact Mass263.09
IUPAC Name2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide
SMILESNC(=O)CS(=O)(=O)CCC(=O)N1CCNCC1
InChIInChI=1S/C9H17N3O4S/c10-8(13)7-17(15,16)6-1-9(14)12-4-2-11-3-5-12/h11H,1-7H2,(H2,10,13)
InChIKeyXDPZVIPICMPKIS-UHFFFAOYSA-N
XLogP-2.29
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 5-2.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide 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

2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetic acid
CID 82182500
3-methylsulfonyl-1-piperazin-1-ylpropan-1-one
CID 61003211
4-(2-oxo-2-piperazin-1-ylethyl)sulfonylbutanoic acid
CID 82182894
1,10-di(piperazin-1-yl)decane-1,10-dione
CID 19981244
1-piperazin-1-ylbutan-1-one;hydrochloride
CID 67460380
3-(2-morpholin-4-yl-2-oxoethyl)sulfonylpropanethioamide
CID 82182221
butanedioic acid;bis(piperazine-1-carboxamide)
CID 174927444
N,N-diethyl-2-oxo-2-piperazin-1-ylethanesulfonamide;hydrochloride
CID 119403914
piperazine-1-carboxamide;zinc
CID 175213463
2-[(2-amino-2-oxoethyl)-[2-(1,4-diazepan-1-yl)-2-oxoethyl]amino]acetamide
CID 55157405
ethyl 3-[(2-oxo-2-piperazin-1-ylethyl)sulfamoyl]propanoate
CID 61459214
5-oxo-5-piperazin-1-ylpentanehydrazide
CID 2760267

Frequently Asked Questions

What is the IUPAC name of 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide?
The IUPAC name of 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide (CID 82182498) is 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide.
What is the SMILES notation for 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide?
The canonical SMILES for 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide is NC(=O)CS(=O)(=O)CCC(=O)N1CCNCC1.
What is the InChIKey of 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide?
The InChIKey is XDPZVIPICMPKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O4S/c10-8(13)7-17(15,16)6-1-9(14)12-4-2-11-3-5-12/h11H,1-7H2,(H2,10,13).
What are the key properties of 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide?
2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide has a molecular weight of 263.32 g/mol, XLogP of -2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-oxo-3-piperazin-1-ylpropyl)sulfonylacetamide is sourced from PubChem (CID 82182498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).