3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide

C18H17N3O4S — CID 51254507

IUPAC3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(C)no3)cc2)cc1
InChIInChI=1S/C18H17N3O4S/c1-12-3-9-16(10-4-12)26(23,24)21-15-7-5-14(6-8-15)19-18(22)17-11-13(2)20-25-17/h3-11,21H,1-2H3,(H,19,22)
InChIKeyYZEAHVWOEPPLFJ-UHFFFAOYSA-N
MW371.42 g/mol
LogP3.34
Rot. Bonds5

About 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide

3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide (PubChem CID 51254507) has the molecular formula C18H17N3O4S and a molecular weight of 371.42 g/mol. Its IUPAC name is 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide
PubChem CID51254507
Molecular FormulaC18H17N3O4S
Molecular Weight371.42 g/mol
Exact Mass371.09
IUPAC Name3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(C)no3)cc2)cc1
InChIInChI=1S/C18H17N3O4S/c1-12-3-9-16(10-4-12)26(23,24)21-15-7-5-14(6-8-15)19-18(22)17-11-13(2)20-25-17/h3-11,21H,1-2H3,(H,19,22)
InChIKeyYZEAHVWOEPPLFJ-UHFFFAOYSA-N
XLogP3.34
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide 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-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 18128241
N-[4-(cyclohexylsulfamoyl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 43911307
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide
CID 55683934
N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 43911419
N-[3-[(4-fluorophenyl)sulfonylamino]-4-methoxyphenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 31801001
N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 43911337
N-[4-(aminomethyl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 104954922
3-methyl-N-(4-methylsulfanylphenyl)-1,2-oxazole-5-carboxamide
CID 16880199
N-(4-carbamoylphenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 21432228
N-(4-benzamidophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 43911460
3-methyl-N-[4-[(propan-2-ylamino)methyl]phenyl]-1,2-oxazole-5-carboxamide
CID 106910483

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide (CID 51254507) is 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide is Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(C)no3)cc2)cc1.
What is the InChIKey of 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide?
The InChIKey is YZEAHVWOEPPLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S/c1-12-3-9-16(10-4-12)26(23,24)21-15-7-5-14(6-8-15)19-18(22)17-11-13(2)20-25-17/h3-11,21H,1-2H3,(H,19,22).
What are the key properties of 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide?
3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide has a molecular weight of 371.42 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 51254507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).