3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide

C12H14N2O3S — CID 5165886

IUPAC3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2c(C)noc2C)cc1
InChIInChI=1S/C12H14N2O3S/c1-8-4-6-11(7-5-8)14-18(15,16)12-9(2)13-17-10(12)3/h4-7,14H,1-3H3
InChIKeyYXYSUKGXZIOMHG-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.40
Rot. Bonds3

About 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide

3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide (PubChem CID 5165886) has the molecular formula C12H14N2O3S and a molecular weight of 266.32 g/mol. Its IUPAC name is 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound Name3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide
PubChem CID5165886
Molecular FormulaC12H14N2O3S
Molecular Weight266.32 g/mol
Exact Mass266.07
IUPAC Name3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide
SMILESCc1ccc(NS(=O)(=O)c2c(C)noc2C)cc1
InChIInChI=1S/C12H14N2O3S/c1-8-4-6-11(7-5-8)14-18(15,16)12-9(2)13-17-10(12)3/h4-7,14H,1-3H3
InChIKeyYXYSUKGXZIOMHG-UHFFFAOYSA-N
XLogP2.40
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide 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

Sulfisoxazole
CID 5344
[3-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonylamino]phenyl]boronic acid
CID 46890018
3,5-dimethyl-N-(2-phenylethyl)-N-(phenylmethyl)-4-isoxazolesulfonamide
CID 3239540
N-benzyl-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 2741492
Methyl 2-{[(3,5-dimethyl-4-isoxazolyl)sulfonyl]amino}benzoate
CID 2812754
N-[3-(hydroxymethyl)phenyl]-3,5-dimethyl-4-isoxazolesulfonamide
CID 2813979
N-ethyl-3,5-dimethyl-N-phenyl-1,2-oxazole-4-sulfonamide
CID 3609627
N-[(3-chlorophenyl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 4988738
3,5-dimethyl-N-(2,4,6-trimethylphenyl)-1,2-oxazole-4-sulfonamide
CID 8061730
1-[(3,5-dimethylisoxazol-4-yl)sulfonyl]-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 7436932
3,5-dimethyl-N-[3-(trifluoromethyl)phenyl]-1,2-oxazole-4-sulfonamide
CID 3861893
3,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]-1,2-oxazole-4-sulfonamide
CID 3241534

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide?
The IUPAC name of 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide (CID 5165886) is 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide?
The canonical SMILES for 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide is Cc1ccc(NS(=O)(=O)c2c(C)noc2C)cc1.
What is the InChIKey of 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide?
The InChIKey is YXYSUKGXZIOMHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3S/c1-8-4-6-11(7-5-8)14-18(15,16)12-9(2)13-17-10(12)3/h4-7,14H,1-3H3.
What are the key properties of 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide?
3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide has a molecular weight of 266.32 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(4-methylphenyl)-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 5165886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).