2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran

C21H16O2 — CID 141017099

IUPAC2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
SMILESCOc1ccc(-c2ccc(-c3cc4ccccc4o3)cc2)cc1
InChIInChI=1S/C21H16O2/c1-22-19-12-10-16(11-13-19)15-6-8-17(9-7-15)21-14-18-4-2-3-5-20(18)23-21/h2-14H,1H3
InChIKeyBGOQFTQYSZKTBZ-UHFFFAOYSA-N
MW300.36 g/mol
LogP5.78
Rot. Bonds3

About 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran

2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran (PubChem CID 141017099) has the molecular formula C21H16O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran.

Molecular Properties

Compound Name2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
PubChem CID141017099
Molecular FormulaC21H16O2
Molecular Weight300.36 g/mol
Exact Mass300.12
IUPAC Name2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
SMILESCOc1ccc(-c2ccc(-c3cc4ccccc4o3)cc2)cc1
InChIInChI=1S/C21H16O2/c1-22-19-12-10-16(11-13-19)15-6-8-17(9-7-15)21-14-18-4-2-3-5-20(18)23-21/h2-14H,1H3
InChIKeyBGOQFTQYSZKTBZ-UHFFFAOYSA-N
XLogP5.78
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.36
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methoxyphenyl)-1-benzofuran
CID 10727834
2-(4-methoxyphenyl)-5-phenyl-1-benzofuran
CID 66549379
2-[6-(1-benzofuran-2-yl)-3,8-bis(4-methoxyphenyl)pyren-1-yl]-1-benzofuran
CID 59390327
4-(1-benzofuran-2-yl)-6-(4-methoxyphenyl)pyrimidin-2-amine
CID 11381541
2-(4-methoxyphenyl)-1-benzofuran-6-ol
CID 14887928
2-[4-(3-methylphenyl)phenyl]-1-benzofuran
CID 132966930
methyl 2-[4-[4-(1-benzofuran-2-yl)phenyl]phenoxy]-2-phenylacetate
CID 11327979
1-[4-(1-benzofuran-2-yl)phenoxy]-3-methylbutan-2-amine
CID 146224407
4-[4-(1-benzofuran-2-yl)phenyl]-N-[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-N-phenylaniline
CID 164744662
2-(2-ethynyl-4-methoxyphenyl)-1-benzofuran
CID 122232359
4-(1-benzofuran-2-yl)-N,N-diphenylaniline
CID 139080403
4-(6-methoxy-1-benzofuran-2-yl)-1-methylpyridin-1-ium
CID 23312199

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran?
The IUPAC name of 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran (CID 141017099) is 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran.
What is the SMILES notation for 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran?
The canonical SMILES for 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran is COc1ccc(-c2ccc(-c3cc4ccccc4o3)cc2)cc1.
What is the InChIKey of 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran?
The InChIKey is BGOQFTQYSZKTBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16O2/c1-22-19-12-10-16(11-13-19)15-6-8-17(9-7-15)21-14-18-4-2-3-5-20(18)23-21/h2-14H,1H3.
What are the key properties of 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran?
2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran has a molecular weight of 300.36 g/mol, XLogP of 5.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran is sourced from PubChem (CID 141017099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).