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

C15H12N2O2S — CID 53143174

IUPAC2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cc(-c2cccs2)no1
InChIInChI=1S/C15H12N2O2S/c1-10-5-2-3-6-11(10)15(18)16-14-9-12(17-19-14)13-7-4-8-20-13/h2-9H,1H3,(H,16,18)
InChIKeyCCOGTSVNQXZUBX-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.96
Rot. Bonds3

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

2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide (PubChem CID 53143174) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide
PubChem CID53143174
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cc(-c2cccs2)no1
InChIInChI=1S/C15H12N2O2S/c1-10-5-2-3-6-11(10)15(18)16-14-9-12(17-19-14)13-7-4-8-20-13/h2-9H,1H3,(H,16,18)
InChIKeyCCOGTSVNQXZUBX-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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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide?
The IUPAC name of 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide (CID 53143174) is 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide?
The canonical SMILES for 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide is Cc1ccccc1C(=O)Nc1cc(-c2cccs2)no1.
What is the InChIKey of 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide?
The InChIKey is CCOGTSVNQXZUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c1-10-5-2-3-6-11(10)15(18)16-14-9-12(17-19-14)13-7-4-8-20-13/h2-9H,1H3,(H,16,18).
What are the key properties of 2-methyl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)benzamide?
2-methyl-N-(3-thiophen-2-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-2-yl-1,2-oxazol-5-yl)benzamide is sourced from PubChem (CID 53143174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).