(1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide

C6H12N2O3S — CID 130942759

IUPAC(1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide
SMILESCN1CCC(CS(N)(=O)=O)C1=O
InChIInChI=1S/C6H12N2O3S/c1-8-3-2-5(6(8)9)4-12(7,10)11/h5H,2-4H2,1H3,(H2,7,10,11)
InChIKeySFLPOIQEWLFPEL-UHFFFAOYSA-N
MW192.24 g/mol
LogP-1.25
Rot. Bonds2

About (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide

(1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide (PubChem CID 130942759) has the molecular formula C6H12N2O3S and a molecular weight of 192.24 g/mol. Its IUPAC name is (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide.

Molecular Properties

Compound Name(1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide
PubChem CID130942759
Molecular FormulaC6H12N2O3S
Molecular Weight192.24 g/mol
Exact Mass192.06
IUPAC Name(1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide
SMILESCN1CCC(CS(N)(=O)=O)C1=O
InChIInChI=1S/C6H12N2O3S/c1-8-3-2-5(6(8)9)4-12(7,10)11/h5H,2-4H2,1H3,(H2,7,10,11)
InChIKeySFLPOIQEWLFPEL-UHFFFAOYSA-N
XLogP-1.25
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 5-1.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide?
The IUPAC name of (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide (CID 130942759) is (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide.
What is the SMILES notation for (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide?
The canonical SMILES for (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide is CN1CCC(CS(N)(=O)=O)C1=O.
What is the InChIKey of (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide?
The InChIKey is SFLPOIQEWLFPEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3S/c1-8-3-2-5(6(8)9)4-12(7,10)11/h5H,2-4H2,1H3,(H2,7,10,11).
What are the key properties of (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide?
(1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide has a molecular weight of 192.24 g/mol, XLogP of -1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-2-oxopyrrolidin-3-yl)methanesulfonamide is sourced from PubChem (CID 130942759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).