1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone

C17H14O3 — CID 154175742

IUPAC1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone
SMILESCOc1cccc2c(C(C)=O)c(-c3ccccc3)oc12
InChIInChI=1S/C17H14O3/c1-11(18)15-13-9-6-10-14(19-2)17(13)20-16(15)12-7-4-3-5-8-12/h3-10H,1-2H3
InChIKeyZACCJTVJGOHBGN-UHFFFAOYSA-N
MW266.30 g/mol
LogP4.31
Rot. Bonds3

About 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone

1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone (PubChem CID 154175742) has the molecular formula C17H14O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone.

Molecular Properties

Compound Name1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone
PubChem CID154175742
Molecular FormulaC17H14O3
Molecular Weight266.30 g/mol
Exact Mass266.09
IUPAC Name1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone
SMILESCOc1cccc2c(C(C)=O)c(-c3ccccc3)oc12
InChIInChI=1S/C17H14O3/c1-11(18)15-13-9-6-10-14(19-2)17(13)20-16(15)12-7-4-3-5-8-12/h3-10H,1-2H3
InChIKeyZACCJTVJGOHBGN-UHFFFAOYSA-N
XLogP4.31
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone?
The IUPAC name of 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone (CID 154175742) is 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone.
What is the SMILES notation for 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone?
The canonical SMILES for 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone is COc1cccc2c(C(C)=O)c(-c3ccccc3)oc12.
What is the InChIKey of 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone?
The InChIKey is ZACCJTVJGOHBGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O3/c1-11(18)15-13-9-6-10-14(19-2)17(13)20-16(15)12-7-4-3-5-8-12/h3-10H,1-2H3.
What are the key properties of 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone?
1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone has a molecular weight of 266.30 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-methoxy-2-phenyl-1-benzofuran-3-yl)ethanone is sourced from PubChem (CID 154175742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).