5-methoxy-2-(4-methoxyphenyl)-1-benzofuran

C16H14O3 — CID 11161125

IUPAC5-methoxy-2-(4-methoxyphenyl)-1-benzofuran
SMILESCOc1ccc(-c2cc3cc(OC)ccc3o2)cc1
InChIInChI=1S/C16H14O3/c1-17-13-5-3-11(4-6-13)16-10-12-9-14(18-2)7-8-15(12)19-16/h3-10H,1-2H3
InChIKeyVQPRVSDNFHTZME-UHFFFAOYSA-N
MW254.28 g/mol
LogP4.12
Rot. Bonds3

About 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran

5-methoxy-2-(4-methoxyphenyl)-1-benzofuran (PubChem CID 11161125) has the molecular formula C16H14O3 and a molecular weight of 254.28 g/mol. Its IUPAC name is 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran.

Molecular Properties

Compound Name5-methoxy-2-(4-methoxyphenyl)-1-benzofuran
PubChem CID11161125
Molecular FormulaC16H14O3
Molecular Weight254.28 g/mol
Exact Mass254.09
IUPAC Name5-methoxy-2-(4-methoxyphenyl)-1-benzofuran
SMILESCOc1ccc(-c2cc3cc(OC)ccc3o2)cc1
InChIInChI=1S/C16H14O3/c1-17-13-5-3-11(4-6-13)16-10-12-9-14(18-2)7-8-15(12)19-16/h3-10H,1-2H3
InChIKeyVQPRVSDNFHTZME-UHFFFAOYSA-N
XLogP4.12
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.28
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran?
The IUPAC name of 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran (CID 11161125) is 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran.
What is the SMILES notation for 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran?
The canonical SMILES for 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran is COc1ccc(-c2cc3cc(OC)ccc3o2)cc1.
What is the InChIKey of 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran?
The InChIKey is VQPRVSDNFHTZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O3/c1-17-13-5-3-11(4-6-13)16-10-12-9-14(18-2)7-8-15(12)19-16/h3-10H,1-2H3.
What are the key properties of 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran?
5-methoxy-2-(4-methoxyphenyl)-1-benzofuran has a molecular weight of 254.28 g/mol, XLogP of 4.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(4-methoxyphenyl)-1-benzofuran is sourced from PubChem (CID 11161125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).