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

C21H16O2 — CID 66549379

IUPAC2-(4-methoxyphenyl)-5-phenyl-1-benzofuran
SMILESCOc1ccc(-c2cc3cc(-c4ccccc4)ccc3o2)cc1
InChIInChI=1S/C21H16O2/c1-22-19-10-7-16(8-11-19)21-14-18-13-17(9-12-20(18)23-21)15-5-3-2-4-6-15/h2-14H,1H3
InChIKeyLGOUVKCDMSVZRK-UHFFFAOYSA-N
MW300.36 g/mol
LogP5.78
Rot. Bonds3

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

2-(4-methoxyphenyl)-5-phenyl-1-benzofuran (PubChem CID 66549379) has the molecular formula C21H16O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-phenyl-1-benzofuran
PubChem CID66549379
Molecular FormulaC21H16O2
Molecular Weight300.36 g/mol
Exact Mass300.12
IUPAC Name2-(4-methoxyphenyl)-5-phenyl-1-benzofuran
SMILESCOc1ccc(-c2cc3cc(-c4ccccc4)ccc3o2)cc1
InChIInChI=1S/C21H16O2/c1-22-19-10-7-16(8-11-19)21-14-18-13-17(9-12-20(18)23-21)15-5-3-2-4-6-15/h2-14H,1H3
InChIKeyLGOUVKCDMSVZRK-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-(4-methoxyphenyl)phenyl]-1-benzofuran
CID 141017099
2-(4-methoxyphenyl)-1-benzofuran
CID 10727834
5-(4-methoxyphenyl)-2,3-diphenylfuran
CID 2733040
2-methoxy-6-phenylnaphthalene
CID 11253308
5-methoxy-2-(4-nitrophenyl)-1-benzofuran
CID 11680584
tert-butyl-[[2-(4-methoxyphenyl)-1-benzofuran-5-yl]oxy]-dimethylsilane
CID 68967722
5-phenyl-2-[4-[2-[4-(5-phenyl-1-benzofuran-2-yl)phenyl]-[1]benzothiolo[3,2-b][1]benzothiol-7-yl]phenyl]-1-benzofuran
CID 138646490
2-[5-(4-methoxyphenyl)-1-benzofuran-2-yl]-4,5-dihydro-1H-imidazole
CID 22083539
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
2-(4-phenylphenyl)-1-benzofuran-5-carbonitrile
CID 135058554
2-methoxynaphthalene;2-phenylnaphthalene
CID 173269029
6-methoxy-2-phenylchromen-4-one;hydrate
CID 174958280

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran?
The IUPAC name of 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran (CID 66549379) is 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran?
The canonical SMILES for 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran is COc1ccc(-c2cc3cc(-c4ccccc4)ccc3o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran?
The InChIKey is LGOUVKCDMSVZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16O2/c1-22-19-10-7-16(8-11-19)21-14-18-13-17(9-12-20(18)23-21)15-5-3-2-4-6-15/h2-14H,1H3.
What are the key properties of 2-(4-methoxyphenyl)-5-phenyl-1-benzofuran?
2-(4-methoxyphenyl)-5-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-methoxyphenyl)-5-phenyl-1-benzofuran is sourced from PubChem (CID 66549379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).