3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide

C10H11N3O3S — CID 14150694

IUPAC3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
SMILESCc1cc(NS(=O)(=O)c2cccc(N)c2)no1
InChIInChI=1S/C10H11N3O3S/c1-7-5-10(12-16-7)13-17(14,15)9-4-2-3-8(11)6-9/h2-6H,11H2,1H3,(H,12,13)
InChIKeyOMKFUEYDLXFJPY-UHFFFAOYSA-N
MW253.28 g/mol
LogP1.37
Rot. Bonds3

About 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide

3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide (PubChem CID 14150694) has the molecular formula C10H11N3O3S and a molecular weight of 253.28 g/mol. Its IUPAC name is 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
PubChem CID14150694
Molecular FormulaC10H11N3O3S
Molecular Weight253.28 g/mol
Exact Mass253.05
IUPAC Name3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
SMILESCc1cc(NS(=O)(=O)c2cccc(N)c2)no1
InChIInChI=1S/C10H11N3O3S/c1-7-5-10(12-16-7)13-17(14,15)9-4-2-3-8(11)6-9/h2-6H,11H2,1H3,(H,12,13)
InChIKeyOMKFUEYDLXFJPY-UHFFFAOYSA-N
XLogP1.37
TPSA98.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

CID 57350054
CID 57350054
N-(5-methyl-1,2-oxazol-3-yl)-3-(trifluoromethyl)benzenesulfonamide
CID 8519021
3-amino-N-(3-methyl-1,2-oxazol-4-yl)benzenesulfonamide
CID 140762991
2-amino-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-sulfonamide
CID 62149534
4-amino-2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 22411411
4-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 670321
N-(4-methoxyphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide
CID 27229043
4-amino-2-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 43257220
4-(chloroamino)-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 162345507
4-(methanesulfonamido)-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 2446459
3-(4-acetylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 109064428
3-amino-N-(4-methylphenyl)benzenesulfonamide;hydrochloride
CID 134103318

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide?
The IUPAC name of 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide (CID 14150694) is 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide?
The canonical SMILES for 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide is Cc1cc(NS(=O)(=O)c2cccc(N)c2)no1.
What is the InChIKey of 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide?
The InChIKey is OMKFUEYDLXFJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3S/c1-7-5-10(12-16-7)13-17(14,15)9-4-2-3-8(11)6-9/h2-6H,11H2,1H3,(H,12,13).
What are the key properties of 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide?
3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide has a molecular weight of 253.28 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 14150694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).