4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide

C16H14N2O4S — CID 18166113

IUPAC4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide
SMILESCOc1ccc(C(N)=O)c(OCc2coc(-c3cccs3)n2)c1
InChIInChI=1S/C16H14N2O4S/c1-20-11-4-5-12(15(17)19)13(7-11)21-8-10-9-22-16(18-10)14-3-2-6-23-14/h2-7,9H,8H2,1H3,(H2,17,19)
InChIKeyDHRMPAVRWCUJSS-UHFFFAOYSA-N
MW330.37 g/mol
LogP3.09
Rot. Bonds6

About 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide

4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide (PubChem CID 18166113) has the molecular formula C16H14N2O4S and a molecular weight of 330.37 g/mol. Its IUPAC name is 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide.

Molecular Properties

Compound Name4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide
PubChem CID18166113
Molecular FormulaC16H14N2O4S
Molecular Weight330.37 g/mol
Exact Mass330.07
IUPAC Name4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide
SMILESCOc1ccc(C(N)=O)c(OCc2coc(-c3cccs3)n2)c1
InChIInChI=1S/C16H14N2O4S/c1-20-11-4-5-12(15(17)19)13(7-11)21-8-10-9-22-16(18-10)14-3-2-6-23-14/h2-7,9H,8H2,1H3,(H2,17,19)
InChIKeyDHRMPAVRWCUJSS-UHFFFAOYSA-N
XLogP3.09
TPSA87.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide?
The IUPAC name of 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide (CID 18166113) is 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide.
What is the SMILES notation for 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide?
The canonical SMILES for 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide is COc1ccc(C(N)=O)c(OCc2coc(-c3cccs3)n2)c1.
What is the InChIKey of 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide?
The InChIKey is DHRMPAVRWCUJSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O4S/c1-20-11-4-5-12(15(17)19)13(7-11)21-8-10-9-22-16(18-10)14-3-2-6-23-14/h2-7,9H,8H2,1H3,(H2,17,19).
What are the key properties of 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide?
4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide has a molecular weight of 330.37 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide is sourced from PubChem (CID 18166113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).