4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide

C12H12N2O3S — CID 122187162

IUPAC4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2cnc(C3CC3)o2)cc1
InChIInChI=1S/C12H12N2O3S/c13-18(15,16)10-5-3-8(4-6-10)11-7-14-12(17-11)9-1-2-9/h3-7,9H,1-2H2,(H2,13,15,16)
InChIKeyMGDZQOHHFLKMNE-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.87
Rot. Bonds3

About 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide

4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide (PubChem CID 122187162) has the molecular formula C12H12N2O3S and a molecular weight of 264.31 g/mol. Its IUPAC name is 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide
PubChem CID122187162
Molecular FormulaC12H12N2O3S
Molecular Weight264.31 g/mol
Exact Mass264.06
IUPAC Name4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2cnc(C3CC3)o2)cc1
InChIInChI=1S/C12H12N2O3S/c13-18(15,16)10-5-3-8(4-6-10)11-7-14-12(17-11)9-1-2-9/h3-7,9H,1-2H2,(H2,13,15,16)
InChIKeyMGDZQOHHFLKMNE-UHFFFAOYSA-N
XLogP1.87
TPSA86.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide 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

4-(2-Methyl-1,3-oxazol-5-yl)benzenesulfonamide
CID 91595667
4-(2-Cyclobutyl-1,3-oxazol-5-yl)benzenesulfonamide
CID 122187163
4-[2-(Pyrrolidine-1-carbonyl)-1,3-oxazol-5-yl]benzenesulfonamide
CID 122187164
4-[2-(Morpholine-4-carbonyl)-1,3-oxazol-5-yl]benzenesulfonamide
CID 122187165
2-Methyl-5-[2-(pyrrolidine-1-carbonyl)-1,3-oxazol-5-yl]benzenesulfonamide
CID 122187172
2-Methyl-5-[2-(morpholine-4-carbonyl)-1,3-oxazol-5-yl]benzenesulfonamide
CID 122187173
2-Cyclohexyl-5-phenyloxazole
CID 87832
2-Methyl-5-Phenyl-1,3-Oxazole
CID 248491
N-piperidin-4-yl-5-(4-sulfamoylphenyl)-1,3-oxazole-2-carboxamide
CID 155527975
4-[2-(4-Aminopiperidine-1-carbonyl)-1,3-oxazol-5-yl]benzenesulfonamide
CID 155551316
4-(2-(7-Phenylheptanoyl)oxazol-5-yl)benzenesulfonamide
CID 16110647
3-(2-(7-Phenylheptanoyl)oxazol-5-yl)benzenesulfonamide
CID 16110701

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide?
The IUPAC name of 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide (CID 122187162) is 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide?
The canonical SMILES for 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide is NS(=O)(=O)c1ccc(-c2cnc(C3CC3)o2)cc1.
What is the InChIKey of 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide?
The InChIKey is MGDZQOHHFLKMNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3S/c13-18(15,16)10-5-3-8(4-6-10)11-7-14-12(17-11)9-1-2-9/h3-7,9H,1-2H2,(H2,13,15,16).
What are the key properties of 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide?
4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide has a molecular weight of 264.31 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropyl-1,3-oxazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 122187162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).