N-(1,2-oxazol-4-yl)benzenesulfonamide

C9H8N2O3S — CID 54340665

IUPACN-(1,2-oxazol-4-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cnoc1)c1ccccc1
InChIInChI=1S/C9H8N2O3S/c12-15(13,9-4-2-1-3-5-9)11-8-6-10-14-7-8/h1-7,11H
InChIKeyTYSDXKKHWGUBTC-UHFFFAOYSA-N
MW224.24 g/mol
LogP1.48
Rot. Bonds3

About N-(1,2-oxazol-4-yl)benzenesulfonamide

N-(1,2-oxazol-4-yl)benzenesulfonamide (PubChem CID 54340665) has the molecular formula C9H8N2O3S and a molecular weight of 224.24 g/mol. Its IUPAC name is N-(1,2-oxazol-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1,2-oxazol-4-yl)benzenesulfonamide
PubChem CID54340665
Molecular FormulaC9H8N2O3S
Molecular Weight224.24 g/mol
Exact Mass224.03
IUPAC NameN-(1,2-oxazol-4-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cnoc1)c1ccccc1
InChIInChI=1S/C9H8N2O3S/c12-15(13,9-4-2-1-3-5-9)11-8-6-10-14-7-8/h1-7,11H
InChIKeyTYSDXKKHWGUBTC-UHFFFAOYSA-N
XLogP1.48
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 62399730
3-amino-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 62903638
3-(1-hydroxyethyl)-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 62915619
N-(1,2-oxazol-4-yl)-4-[(propan-2-ylamino)methyl]benzenesulfonamide
CID 62902953
N-(1,2-oxazol-4-yl)-3-phenylthiophene-2-sulfonamide
CID 150217087
4-(3-aminoprop-1-ynyl)-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 62913617
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
5-(1,2-oxazol-4-ylsulfamoyl)thiophene-2-carboxylic acid
CID 62904176
2,4-dibromo-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 55125549
4-(methylamino)-3-nitro-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 62914714
N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]-1,2-oxazole-4-sulfonamide
CID 122286500
2-amino-4-bromo-N-(1,2-oxazol-4-yl)benzenesulfonamide
CID 62903642

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-4-yl)benzenesulfonamide?
The IUPAC name of N-(1,2-oxazol-4-yl)benzenesulfonamide (CID 54340665) is N-(1,2-oxazol-4-yl)benzenesulfonamide.
What is the SMILES notation for N-(1,2-oxazol-4-yl)benzenesulfonamide?
The canonical SMILES for N-(1,2-oxazol-4-yl)benzenesulfonamide is O=S(=O)(Nc1cnoc1)c1ccccc1.
What is the InChIKey of N-(1,2-oxazol-4-yl)benzenesulfonamide?
The InChIKey is TYSDXKKHWGUBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O3S/c12-15(13,9-4-2-1-3-5-9)11-8-6-10-14-7-8/h1-7,11H.
What are the key properties of N-(1,2-oxazol-4-yl)benzenesulfonamide?
N-(1,2-oxazol-4-yl)benzenesulfonamide has a molecular weight of 224.24 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-4-yl)benzenesulfonamide is sourced from PubChem (CID 54340665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).