N-(5-oxopyrrolidin-3-yl)ethanesulfonamide

C6H12N2O3S — CID 105056076

IUPACN-(5-oxopyrrolidin-3-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1CNC(=O)C1
InChIInChI=1S/C6H12N2O3S/c1-2-12(10,11)8-5-3-6(9)7-4-5/h5,8H,2-4H2,1H3,(H,7,9)
InChIKeyAYFCCMFTUYVHBF-UHFFFAOYSA-N
MW192.24 g/mol
LogP-1.19
Rot. Bonds3

About N-(5-oxopyrrolidin-3-yl)ethanesulfonamide

N-(5-oxopyrrolidin-3-yl)ethanesulfonamide (PubChem CID 105056076) has the molecular formula C6H12N2O3S and a molecular weight of 192.24 g/mol. Its IUPAC name is N-(5-oxopyrrolidin-3-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(5-oxopyrrolidin-3-yl)ethanesulfonamide
PubChem CID105056076
Molecular FormulaC6H12N2O3S
Molecular Weight192.24 g/mol
Exact Mass192.06
IUPAC NameN-(5-oxopyrrolidin-3-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1CNC(=O)C1
InChIInChI=1S/C6H12N2O3S/c1-2-12(10,11)8-5-3-6(9)7-4-5/h5,8H,2-4H2,1H3,(H,7,9)
InChIKeyAYFCCMFTUYVHBF-UHFFFAOYSA-N
XLogP-1.19
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminophenoxy)-N-(5-oxopyrrolidin-3-yl)ethanesulfonamide
CID 106181130
5-amino-2,3-dimethyl-N-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 106181011
2-methyl-N-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 105056081
(4R)-4-(2-methylpropylamino)pyrrolidin-2-one
CID 139457725
N-(5-oxopyrrolidin-3-yl)-3-propanoylbenzenesulfonamide
CID 104696895
4-(prop-2-ynylamino)pyrrolidin-2-one
CID 106184297
3-amino-4-methyl-N-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 106181069
2-(3-aminophenoxy)-N-(5-oxopyrrolidin-3-yl)ethanesulfonamide
CID 106180836
2-(3-aminophenyl)sulfanyl-N-(5-oxopyrrolidin-3-yl)ethanesulfonamide
CID 106180833
1-ethyl-4-[(5-oxopyrrolidin-3-yl)sulfamoyl]pyrrole-2-carboxylic acid
CID 106185307
5-bromo-4-methyl-N-(5-oxopyrrolidin-3-yl)thiophene-2-sulfonamide
CID 104696894
N-[(3R)-pyrrolidin-3-yl]ethanesulfonamide
CID 79684935

Frequently Asked Questions

What is the IUPAC name of N-(5-oxopyrrolidin-3-yl)ethanesulfonamide?
The IUPAC name of N-(5-oxopyrrolidin-3-yl)ethanesulfonamide (CID 105056076) is N-(5-oxopyrrolidin-3-yl)ethanesulfonamide.
What is the SMILES notation for N-(5-oxopyrrolidin-3-yl)ethanesulfonamide?
The canonical SMILES for N-(5-oxopyrrolidin-3-yl)ethanesulfonamide is CCS(=O)(=O)NC1CNC(=O)C1.
What is the InChIKey of N-(5-oxopyrrolidin-3-yl)ethanesulfonamide?
The InChIKey is AYFCCMFTUYVHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3S/c1-2-12(10,11)8-5-3-6(9)7-4-5/h5,8H,2-4H2,1H3,(H,7,9).
What are the key properties of N-(5-oxopyrrolidin-3-yl)ethanesulfonamide?
N-(5-oxopyrrolidin-3-yl)ethanesulfonamide has a molecular weight of 192.24 g/mol, XLogP of -1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxopyrrolidin-3-yl)ethanesulfonamide is sourced from PubChem (CID 105056076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).