2-(2-ethylphenyl)-7-methoxy-1-benzofuran

C17H16O2 — CID 22734156

IUPAC2-(2-ethylphenyl)-7-methoxy-1-benzofuran
SMILESCCc1ccccc1-c1cc2cccc(OC)c2o1
InChIInChI=1S/C17H16O2/c1-3-12-7-4-5-9-14(12)16-11-13-8-6-10-15(18-2)17(13)19-16/h4-11H,3H2,1-2H3
InChIKeyBDMSGDGWFPMBSE-UHFFFAOYSA-N
MW252.31 g/mol
LogP4.67
Rot. Bonds3

About 2-(2-ethylphenyl)-7-methoxy-1-benzofuran

2-(2-ethylphenyl)-7-methoxy-1-benzofuran (PubChem CID 22734156) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(2-ethylphenyl)-7-methoxy-1-benzofuran.

Molecular Properties

Compound Name2-(2-ethylphenyl)-7-methoxy-1-benzofuran
PubChem CID22734156
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name2-(2-ethylphenyl)-7-methoxy-1-benzofuran
SMILESCCc1ccccc1-c1cc2cccc(OC)c2o1
InChIInChI=1S/C17H16O2/c1-3-12-7-4-5-9-14(12)16-11-13-8-6-10-15(18-2)17(13)19-16/h4-11H,3H2,1-2H3
InChIKeyBDMSGDGWFPMBSE-UHFFFAOYSA-N
XLogP4.67
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenyl)-7-methoxy-1-benzofuran?
The IUPAC name of 2-(2-ethylphenyl)-7-methoxy-1-benzofuran (CID 22734156) is 2-(2-ethylphenyl)-7-methoxy-1-benzofuran.
What is the SMILES notation for 2-(2-ethylphenyl)-7-methoxy-1-benzofuran?
The canonical SMILES for 2-(2-ethylphenyl)-7-methoxy-1-benzofuran is CCc1ccccc1-c1cc2cccc(OC)c2o1.
What is the InChIKey of 2-(2-ethylphenyl)-7-methoxy-1-benzofuran?
The InChIKey is BDMSGDGWFPMBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O2/c1-3-12-7-4-5-9-14(12)16-11-13-8-6-10-15(18-2)17(13)19-16/h4-11H,3H2,1-2H3.
What are the key properties of 2-(2-ethylphenyl)-7-methoxy-1-benzofuran?
2-(2-ethylphenyl)-7-methoxy-1-benzofuran has a molecular weight of 252.31 g/mol, XLogP of 4.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenyl)-7-methoxy-1-benzofuran is sourced from PubChem (CID 22734156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).