(5-oxopyrrolidin-3-yl)methanesulfonamide

C5H10N2O3S — CID 130820135

IUPAC(5-oxopyrrolidin-3-yl)methanesulfonamide
SMILESNS(=O)(=O)CC1CNC(=O)C1
InChIInChI=1S/C5H10N2O3S/c6-11(9,10)3-4-1-5(8)7-2-4/h4H,1-3H2,(H,7,8)(H2,6,9,10)
InChIKeyHNKUIWPBOIHOFA-UHFFFAOYSA-N
MW178.21 g/mol
LogP-1.59
Rot. Bonds2

About (5-oxopyrrolidin-3-yl)methanesulfonamide

(5-oxopyrrolidin-3-yl)methanesulfonamide (PubChem CID 130820135) has the molecular formula C5H10N2O3S and a molecular weight of 178.21 g/mol. Its IUPAC name is (5-oxopyrrolidin-3-yl)methanesulfonamide.

Molecular Properties

Compound Name(5-oxopyrrolidin-3-yl)methanesulfonamide
PubChem CID130820135
Molecular FormulaC5H10N2O3S
Molecular Weight178.21 g/mol
Exact Mass178.04
IUPAC Name(5-oxopyrrolidin-3-yl)methanesulfonamide
SMILESNS(=O)(=O)CC1CNC(=O)C1
InChIInChI=1S/C5H10N2O3S/c6-11(9,10)3-4-1-5(8)7-2-4/h4H,1-3H2,(H,7,8)(H2,6,9,10)
InChIKeyHNKUIWPBOIHOFA-UHFFFAOYSA-N
XLogP-1.59
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 5-1.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-oxopyrrolidin-3-yl)methanesulfonamide?
The IUPAC name of (5-oxopyrrolidin-3-yl)methanesulfonamide (CID 130820135) is (5-oxopyrrolidin-3-yl)methanesulfonamide.
What is the SMILES notation for (5-oxopyrrolidin-3-yl)methanesulfonamide?
The canonical SMILES for (5-oxopyrrolidin-3-yl)methanesulfonamide is NS(=O)(=O)CC1CNC(=O)C1.
What is the InChIKey of (5-oxopyrrolidin-3-yl)methanesulfonamide?
The InChIKey is HNKUIWPBOIHOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3S/c6-11(9,10)3-4-1-5(8)7-2-4/h4H,1-3H2,(H,7,8)(H2,6,9,10).
What are the key properties of (5-oxopyrrolidin-3-yl)methanesulfonamide?
(5-oxopyrrolidin-3-yl)methanesulfonamide has a molecular weight of 178.21 g/mol, XLogP of -1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-oxopyrrolidin-3-yl)methanesulfonamide is sourced from PubChem (CID 130820135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).