5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide

C10H15N3O3S — CID 168718283

IUPAC5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide
SMILESNS(=O)(=O)C1CC(=O)N(CCn2cccc2)C1
InChIInChI=1S/C10H15N3O3S/c11-17(15,16)9-7-10(14)13(8-9)6-5-12-3-1-2-4-12/h1-4,9H,5-8H2,(H2,11,15,16)
InChIKeyWNMFMOSPXFWLPF-UHFFFAOYSA-N
MW257.31 g/mol
LogP-0.62
Rot. Bonds4

About 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide

5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide (PubChem CID 168718283) has the molecular formula C10H15N3O3S and a molecular weight of 257.31 g/mol. Its IUPAC name is 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide.

Molecular Properties

Compound Name5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide
PubChem CID168718283
Molecular FormulaC10H15N3O3S
Molecular Weight257.31 g/mol
Exact Mass257.08
IUPAC Name5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide
SMILESNS(=O)(=O)C1CC(=O)N(CCn2cccc2)C1
InChIInChI=1S/C10H15N3O3S/c11-17(15,16)9-7-10(14)13(8-9)6-5-12-3-1-2-4-12/h1-4,9H,5-8H2,(H2,11,15,16)
InChIKeyWNMFMOSPXFWLPF-UHFFFAOYSA-N
XLogP-0.62
TPSA85.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-1-(2-pyrrol-1-ylethyl)pyrrolidin-2-one
CID 168688689
1-[2-(2,3-dihydroindol-1-yl)ethyl]-5-oxopyrrolidine-3-sulfonamide
CID 168718162
1-(3-methylsulfanylpropyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717537
5-oxo-1-(1H-pyrrol-2-ylmethyl)pyrrolidine-3-sulfonamide
CID 168718383
1-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-5-oxopyrrolidine-3-sulfonamide
CID 168718184
1-[3-(azepan-1-yl)propyl]-5-oxopyrrolidine-3-sulfonamide
CID 168718145
5-oxo-1-prop-2-ynylpyrrolidine-3-sulfonamide
CID 168716757
N,N-dimethyl-2-(2-oxo-4-sulfamoylpyrrolidin-1-yl)acetamide
CID 168717165
5-oxo-1-(3-trimethoxysilylpropyl)pyrrolidine-3-sulfonamide
CID 168717350
1-(3,3-diethoxypropyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717057
1-(2-hydroxy-2-phenylethyl)-5-oxopyrrolidine-3-sulfonamide
CID 168716694
1-[2-(1H-benzimidazol-2-yl)ethyl]-5-oxopyrrolidine-3-sulfonamide
CID 168718272

Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide?
The IUPAC name of 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide (CID 168718283) is 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide.
What is the SMILES notation for 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide?
The canonical SMILES for 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide is NS(=O)(=O)C1CC(=O)N(CCn2cccc2)C1.
What is the InChIKey of 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide?
The InChIKey is WNMFMOSPXFWLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c11-17(15,16)9-7-10(14)13(8-9)6-5-12-3-1-2-4-12/h1-4,9H,5-8H2,(H2,11,15,16).
What are the key properties of 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide?
5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide has a molecular weight of 257.31 g/mol, XLogP of -0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-(2-pyrrol-1-ylethyl)pyrrolidine-3-sulfonamide is sourced from PubChem (CID 168718283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).