2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide

C13H15N3O3S — CID 120999842

IUPAC2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide
SMILESO=S(=O)(NC1CCNC1)c1ccccc1-c1ccno1
InChIInChI=1S/C13H15N3O3S/c17-20(18,16-10-5-7-14-9-10)13-4-2-1-3-11(13)12-6-8-15-19-12/h1-4,6,8,10,14,16H,5,7,9H2
InChIKeyNUEVOHCFMSDPCS-UHFFFAOYSA-N
MW293.35 g/mol
LogP0.98
Rot. Bonds4

About 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide

2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide (PubChem CID 120999842) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide.

Molecular Properties

Compound Name2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide
PubChem CID120999842
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide
SMILESO=S(=O)(NC1CCNC1)c1ccccc1-c1ccno1
InChIInChI=1S/C13H15N3O3S/c17-20(18,16-10-5-7-14-9-10)13-4-2-1-3-11(13)12-6-8-15-19-12/h1-4,6,8,10,14,16H,5,7,9H2
InChIKeyNUEVOHCFMSDPCS-UHFFFAOYSA-N
XLogP0.98
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119967181
N-pyrrolidin-3-yl-2-pyrrolidin-1-ylsulfonylbenzenesulfonamide;hydrochloride
CID 120707575
N-[(3S)-pyrrolidin-3-yl]benzenesulfonamide
CID 79685431
2,3-dichloro-N-[(3S)-pyrrolidin-3-yl]benzenesulfonamide
CID 79684857
3-bromo-2-fluoro-N-pyrrolidin-3-ylbenzenesulfonamide
CID 120707591
N-pyrrolidin-3-ylpyridine-3-sulfonamide
CID 62380285
2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide
CID 104709475
3-fluoro-2-methyl-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119966783
2,3,4-trifluoro-N-pyrrolidin-3-ylbenzenesulfonamide
CID 55068837
2,4-difluoro-N-[(3R)-pyrrolidin-3-yl]benzenesulfonamide
CID 79684830
N-piperidin-3-yl-2-pyrrolidin-1-ylsulfonylbenzenesulfonamide
CID 120707123
N-pyrrolidin-3-yl-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide;hydrochloride
CID 119966914

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide?
The IUPAC name of 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide (CID 120999842) is 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide.
What is the SMILES notation for 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide?
The canonical SMILES for 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide is O=S(=O)(NC1CCNC1)c1ccccc1-c1ccno1.
What is the InChIKey of 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide?
The InChIKey is NUEVOHCFMSDPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c17-20(18,16-10-5-7-14-9-10)13-4-2-1-3-11(13)12-6-8-15-19-12/h1-4,6,8,10,14,16H,5,7,9H2.
What are the key properties of 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide?
2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide has a molecular weight of 293.35 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-oxazol-5-yl)-N-pyrrolidin-3-ylbenzenesulfonamide is sourced from PubChem (CID 120999842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).