1-(2-oxopyrrolidin-3-yl)ethenesulfonamide

C6H10N2O3S — CID 87937102

IUPAC1-(2-oxopyrrolidin-3-yl)ethenesulfonamide
SMILESC=C(C1CCNC1=O)S(N)(=O)=O
InChIInChI=1S/C6H10N2O3S/c1-4(12(7,10)11)5-2-3-8-6(5)9/h5H,1-3H2,(H,8,9)(H2,7,10,11)
InChIKeyPNHKPGFSNPFWGA-UHFFFAOYSA-N
MW190.22 g/mol
LogP-1.08
Rot. Bonds2

About 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide

1-(2-oxopyrrolidin-3-yl)ethenesulfonamide (PubChem CID 87937102) has the molecular formula C6H10N2O3S and a molecular weight of 190.22 g/mol. Its IUPAC name is 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide.

Molecular Properties

Compound Name1-(2-oxopyrrolidin-3-yl)ethenesulfonamide
PubChem CID87937102
Molecular FormulaC6H10N2O3S
Molecular Weight190.22 g/mol
Exact Mass190.04
IUPAC Name1-(2-oxopyrrolidin-3-yl)ethenesulfonamide
SMILESC=C(C1CCNC1=O)S(N)(=O)=O
InChIInChI=1S/C6H10N2O3S/c1-4(12(7,10)11)5-2-3-8-6(5)9/h5H,1-3H2,(H,8,9)(H2,7,10,11)
InChIKeyPNHKPGFSNPFWGA-UHFFFAOYSA-N
XLogP-1.08
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.22
LogP ≤ 5-1.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-2-oxopyrrolidine-3-carboxylic acid
CID 92974819
prop-2-enyl 2-oxopyrrolidine-3-carboxylate
CID 70598263
formamide;(3R)-2-oxopyrrolidine-3-carboxylic acid;hydrochloride
CID 175132511
(3R)-3-hydroxypyrrolidin-2-one
CID 641547
3-aminopyrrolidin-2-one
CID 158709416
3-[3-(methylsulfonylmethyl)pyrrolidine-1-carbonyl]pyrrolidin-2-one
CID 167748482
3-[4-[tert-butyl(dimethyl)silyl]oxybut-1-en-2-yl]pyrrolidin-2-one
CID 89421667
3,4-dibromopiperidin-2-one
CID 67271185
N-[(4-fluorophenyl)methyl]-2-oxopyrrolidine-3-carboxamide
CID 127263481
(4S)-4-amino-3-hydroxyazepan-2-one
CID 130420309
(3R)-3-ethenylpyrrolidin-2-one
CID 143588464
3-(benzenesulfonyl)pyrrolidin-2-one
CID 141214960

Frequently Asked Questions

What is the IUPAC name of 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide?
The IUPAC name of 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide (CID 87937102) is 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide.
What is the SMILES notation for 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide?
The canonical SMILES for 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide is C=C(C1CCNC1=O)S(N)(=O)=O.
What is the InChIKey of 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide?
The InChIKey is PNHKPGFSNPFWGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3S/c1-4(12(7,10)11)5-2-3-8-6(5)9/h5H,1-3H2,(H,8,9)(H2,7,10,11).
What are the key properties of 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide?
1-(2-oxopyrrolidin-3-yl)ethenesulfonamide has a molecular weight of 190.22 g/mol, XLogP of -1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-oxopyrrolidin-3-yl)ethenesulfonamide is sourced from PubChem (CID 87937102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).