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

C15H12N2O3S — CID 53143279

IUPAC3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
SMILESCOc1cccc(C(=O)Nc2cc(-c3ccsc3)no2)c1
InChIInChI=1S/C15H12N2O3S/c1-19-12-4-2-3-10(7-12)15(18)16-14-8-13(17-20-14)11-5-6-21-9-11/h2-9H,1H3,(H,16,18)
InChIKeyFNANYGHTLNVMEK-UHFFFAOYSA-N
MW300.34 g/mol
LogP3.66
Rot. Bonds4

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

3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide (PubChem CID 53143279) has the molecular formula C15H12N2O3S and a molecular weight of 300.34 g/mol. Its IUPAC name is 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
PubChem CID53143279
Molecular FormulaC15H12N2O3S
Molecular Weight300.34 g/mol
Exact Mass300.06
IUPAC Name3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
SMILESCOc1cccc(C(=O)Nc2cc(-c3ccsc3)no2)c1
InChIInChI=1S/C15H12N2O3S/c1-19-12-4-2-3-10(7-12)15(18)16-14-8-13(17-20-14)11-5-6-21-9-11/h2-9H,1H3,(H,16,18)
InChIKeyFNANYGHTLNVMEK-UHFFFAOYSA-N
XLogP3.66
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
The IUPAC name of 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide (CID 53143279) is 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide.
What is the SMILES notation for 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
The canonical SMILES for 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide is COc1cccc(C(=O)Nc2cc(-c3ccsc3)no2)c1.
What is the InChIKey of 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
The InChIKey is FNANYGHTLNVMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3S/c1-19-12-4-2-3-10(7-12)15(18)16-14-8-13(17-20-14)11-5-6-21-9-11/h2-9H,1H3,(H,16,18).
What are the key properties of 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide?
3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide has a molecular weight of 300.34 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide is sourced from PubChem (CID 53143279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).