2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone

C17H16O4 — CID 115814359

IUPAC2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone
SMILESCOc1ccc(OC)c(C(=O)c2cccc3c2OCC3)c1
InChIInChI=1S/C17H16O4/c1-19-12-6-7-15(20-2)14(10-12)16(18)13-5-3-4-11-8-9-21-17(11)13/h3-7,10H,8-9H2,1-2H3
InChIKeyVEASFIUADOEFPG-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.87
Rot. Bonds4

About 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone

2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone (PubChem CID 115814359) has the molecular formula C17H16O4 and a molecular weight of 284.31 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone
PubChem CID115814359
Molecular FormulaC17H16O4
Molecular Weight284.31 g/mol
Exact Mass284.10
IUPAC Name2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone
SMILESCOc1ccc(OC)c(C(=O)c2cccc3c2OCC3)c1
InChIInChI=1S/C17H16O4/c1-19-12-6-7-15(20-2)14(10-12)16(18)13-5-3-4-11-8-9-21-17(11)13/h3-7,10H,8-9H2,1-2H3
InChIKeyVEASFIUADOEFPG-UHFFFAOYSA-N
XLogP2.87
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dihydro-1-benzofuran-7-yl-(3-methoxy-4-methylphenyl)methanone
CID 115814389
3,4-dihydro-2H-chromen-8-yl-(2-fluoro-4-methoxyphenyl)methanone
CID 114744317
2,3-dihydro-1-benzofuran-7-yl-(4-fluoro-3-methoxyphenyl)methanone
CID 115814405
(2,3-dimethoxyphenyl)-(2,5-dimethoxyphenyl)methanone
CID 69347574
2,3-dihydro-1-benzofuran-7-yl-(6-methoxypyrimidin-4-yl)methanone
CID 102950163
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 623894
(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone
CID 146006285
2,3-dihydro-1,4-benzodioxin-5-yl-(5-fluoro-2-methoxyphenyl)methanone
CID 105125143
(2,5-dimethoxyphenyl)-(2-iodophenyl)methanone
CID 15888023
2,3-dihydro-1-benzofuran-7-yl-(2,6-dimethylphenyl)methanone
CID 114026900
(5-chloro-2-methylphenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanone
CID 115814244
3,4-dihydro-2H-pyran-5-yl-(2,5-dimethoxyphenyl)methanone
CID 115798163

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone?
The IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone (CID 115814359) is 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone?
The canonical SMILES for 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone is COc1ccc(OC)c(C(=O)c2cccc3c2OCC3)c1.
What is the InChIKey of 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone?
The InChIKey is VEASFIUADOEFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O4/c1-19-12-6-7-15(20-2)14(10-12)16(18)13-5-3-4-11-8-9-21-17(11)13/h3-7,10H,8-9H2,1-2H3.
What are the key properties of 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone?
2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone has a molecular weight of 284.31 g/mol, XLogP of 2.87, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethoxyphenyl)methanone is sourced from PubChem (CID 115814359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).