4-methoxy-6-(4-methoxyphenyl)pyran-2-one

C13H12O4 — CID 13237931

IUPAC4-methoxy-6-(4-methoxyphenyl)pyran-2-one
SMILESCOc1ccc(-c2cc(OC)cc(=O)o2)cc1
InChIInChI=1S/C13H12O4/c1-15-10-5-3-9(4-6-10)12-7-11(16-2)8-13(14)17-12/h3-8H,1-2H3
InChIKeyUZRWFEOBOBPOOU-UHFFFAOYSA-N
MW232.23 g/mol
LogP2.32
Rot. Bonds3

About 4-methoxy-6-(4-methoxyphenyl)pyran-2-one

4-methoxy-6-(4-methoxyphenyl)pyran-2-one (PubChem CID 13237931) has the molecular formula C13H12O4 and a molecular weight of 232.23 g/mol. Its IUPAC name is 4-methoxy-6-(4-methoxyphenyl)pyran-2-one.

Molecular Properties

Compound Name4-methoxy-6-(4-methoxyphenyl)pyran-2-one
PubChem CID13237931
Molecular FormulaC13H12O4
Molecular Weight232.23 g/mol
Exact Mass232.07
IUPAC Name4-methoxy-6-(4-methoxyphenyl)pyran-2-one
SMILESCOc1ccc(-c2cc(OC)cc(=O)o2)cc1
InChIInChI=1S/C13H12O4/c1-15-10-5-3-9(4-6-10)12-7-11(16-2)8-13(14)17-12/h3-8H,1-2H3
InChIKeyUZRWFEOBOBPOOU-UHFFFAOYSA-N
XLogP2.32
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4,9,14-tris(4-methoxyphenyl)-3,8,13-trioxatetracyclo[10.3.0.02,6.07,11]pentadeca-1,4,6,9,11,14-hexaene
CID 102345821
4-methoxy-6-[(2S,3R)-3-(4-methoxyphenyl)oxiran-2-yl]pyran-2-one
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5-(4-methoxyphenyl)-1,2-oxazol-3-one
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CID 14592116
1-[5-methoxy-2-(4-methoxyphenyl)-1-benzofuran-7-yl]ethanone
CID 22221637
6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one
CID 155754088
2-(4-methoxyphenyl)-5-methylfuran
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6-methoxy-4-(4-methoxyphenyl)chromen-2-one
CID 10516997
methyl 2-methoxy-5-(4-methoxyphenyl)furan-3-carboxylate
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2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
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CID 171716334

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(4-methoxyphenyl)pyran-2-one?
The IUPAC name of 4-methoxy-6-(4-methoxyphenyl)pyran-2-one (CID 13237931) is 4-methoxy-6-(4-methoxyphenyl)pyran-2-one.
What is the SMILES notation for 4-methoxy-6-(4-methoxyphenyl)pyran-2-one?
The canonical SMILES for 4-methoxy-6-(4-methoxyphenyl)pyran-2-one is COc1ccc(-c2cc(OC)cc(=O)o2)cc1.
What is the InChIKey of 4-methoxy-6-(4-methoxyphenyl)pyran-2-one?
The InChIKey is UZRWFEOBOBPOOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O4/c1-15-10-5-3-9(4-6-10)12-7-11(16-2)8-13(14)17-12/h3-8H,1-2H3.
What are the key properties of 4-methoxy-6-(4-methoxyphenyl)pyran-2-one?
4-methoxy-6-(4-methoxyphenyl)pyran-2-one has a molecular weight of 232.23 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(4-methoxyphenyl)pyran-2-one is sourced from PubChem (CID 13237931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).