2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide

C15H12N2O2S — CID 53143273

IUPAC2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cc(-c2ccsc2)no1
InChIInChI=1S/C15H12N2O2S/c1-10-4-2-3-5-12(10)15(18)16-14-8-13(17-19-14)11-6-7-20-9-11/h2-9H,1H3,(H,16,18)
InChIKeyXRYJLDLJWVTTAN-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.96
Rot. Bonds3

About 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide

2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide (PubChem CID 53143273) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
PubChem CID53143273
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cc(-c2ccsc2)no1
InChIInChI=1S/C15H12N2O2S/c1-10-4-2-3-5-12(10)15(18)16-14-8-13(17-19-14)11-6-7-20-9-11/h2-9H,1H3,(H,16,18)
InChIKeyXRYJLDLJWVTTAN-UHFFFAOYSA-N
XLogP3.96
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)(5-(2-thienyl)isoxazol-3-yl)carboxamide
CID 17253076
3-(3,4-Dimethyl-isoxazol-5-ylsulfamoyl)-thiophene-2-carboxylic acid p-tolylamide
CID 10548486
N-(4-ethylphenyl)-5-thien-2-ylisoxazole-3-carboxamide
CID 15988671
N-(2-ethylphenyl)(5-(2-thienyl)isoxazol-3-yl)carboxamide
CID 3337764
N-(4-acetylphenyl)(5-(2-thienyl)isoxazol-3-yl)carboxamide
CID 17253069
N-(4-methylphenyl)-2-(5-thiophen-2-yl-1,2-oxazol-3-yl)acetamide
CID 16879494
N-[3-(5-sulfamoylthiophen-3-yl)-1,2-oxazol-5-yl]acetamide
CID 132961363
3-(3,4-Dimethyl-isoxazol-5-ylsulfamoyl)-thiophene-2-carboxylic acid phenylamide
CID 23445445
Acetamide, N-(3-(2-thienyl)-5-isoxazolyl)-
CID 216899
N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-5-methyl-3-thiophenecarboxamide
CID 1245720
N-(4-methylphenyl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
CID 2745202
N-(3,4-dimethylphenyl)-5-thien-2-ylisoxazole-3-carboxamide
CID 15988684

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
The IUPAC name of 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide (CID 53143273) is 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
The canonical SMILES for 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide is Cc1ccccc1C(=O)Nc1cc(-c2ccsc2)no1.
What is the InChIKey of 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
The InChIKey is XRYJLDLJWVTTAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c1-10-4-2-3-5-12(10)15(18)16-14-8-13(17-19-14)11-6-7-20-9-11/h2-9H,1H3,(H,16,18).
What are the key properties of 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide has a molecular weight of 284.34 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide is sourced from PubChem (CID 53143273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).