N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide

C14H18N2O4S — CID 138992695

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide
SMILESCOc1c(C)cc(C)cc1S(=O)(=O)Nc1c(C)noc1C
InChIInChI=1S/C14H18N2O4S/c1-8-6-9(2)14(19-5)12(7-8)21(17,18)16-13-10(3)15-20-11(13)4/h6-7,16H,1-5H3
InChIKeyIADZIRPPYMIYMF-UHFFFAOYSA-N
MW310.38 g/mol
LogP2.72
Rot. Bonds4

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide (PubChem CID 138992695) has the molecular formula C14H18N2O4S and a molecular weight of 310.38 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide
PubChem CID138992695
Molecular FormulaC14H18N2O4S
Molecular Weight310.38 g/mol
Exact Mass310.10
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide
SMILESCOc1c(C)cc(C)cc1S(=O)(=O)Nc1c(C)noc1C
InChIInChI=1S/C14H18N2O4S/c1-8-6-9(2)14(19-5)12(7-8)21(17,18)16-13-10(3)15-20-11(13)4/h6-7,16H,1-5H3
InChIKeyIADZIRPPYMIYMF-UHFFFAOYSA-N
XLogP2.72
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide 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

N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 110789514
N-(3,5-dimethyl-1,2-oxazol-4-yl)benzenesulfonamide
CID 71935895
cis-(1S,2R)-N-(2-methoxy-3,5-dimethylphenyl)sulfonyl-2-methylcyclopropane-1-carboxamide
CID 124847314
2-methoxy-3,5-dimethyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
CID 110758317
4-(2-methoxy-3,5-dimethylphenyl)sulfonylmorpholine
CID 110758314
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 71894477
4-methoxy-2,3-dimethyl-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 100710078
3,5-dimethyl-N-(2,3,5,6-tetramethylphenyl)-1,2-oxazole-4-sulfonamide
CID 110776931
2-methoxy-4-methyl-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 50876761
N-[5-[(Z)-2-[3-[(2,5-dimethylphenyl)sulfamoyl]-4-methoxyphenyl]ethenyl]-3-methyl-1,2-oxazol-4-yl]acetamide
CID 46394110
N-[(1-aminocyclohexyl)methyl]-2-methoxy-3,5-dimethylbenzenesulfonamide;hydrochloride
CID 120998687
1-(2-methoxy-3,5-dimethylphenyl)sulfonylazepane
CID 110758344

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide (CID 138992695) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide is COc1c(C)cc(C)cc1S(=O)(=O)Nc1c(C)noc1C.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide?
The InChIKey is IADZIRPPYMIYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4S/c1-8-6-9(2)14(19-5)12(7-8)21(17,18)16-13-10(3)15-20-11(13)4/h6-7,16H,1-5H3.
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide has a molecular weight of 310.38 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxy-3,5-dimethylbenzenesulfonamide is sourced from PubChem (CID 138992695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).