1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone

C18H14O2 — CID 106893049

IUPAC1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone
SMILESO=C(c1coc2ccccc12)C1Cc2ccccc2C1
InChIInChI=1S/C18H14O2/c19-18(14-9-12-5-1-2-6-13(12)10-14)16-11-20-17-8-4-3-7-15(16)17/h1-8,11,14H,9-10H2
InChIKeyWSQMBVHIRMLVNJ-UHFFFAOYSA-N
MW262.31 g/mol
LogP4.03
Rot. Bonds2

About 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone

1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone (PubChem CID 106893049) has the molecular formula C18H14O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone.

Molecular Properties

Compound Name1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone
PubChem CID106893049
Molecular FormulaC18H14O2
Molecular Weight262.31 g/mol
Exact Mass262.10
IUPAC Name1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone
SMILESO=C(c1coc2ccccc12)C1Cc2ccccc2C1
InChIInChI=1S/C18H14O2/c19-18(14-9-12-5-1-2-6-13(12)10-14)16-11-20-17-8-4-3-7-15(16)17/h1-8,11,14H,9-10H2
InChIKeyWSQMBVHIRMLVNJ-UHFFFAOYSA-N
XLogP4.03
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzofuran-3-yl(8-oxabicyclo[3.2.1]octan-3-yl)methanone
CID 171945816
8-azabicyclo[3.2.1]octan-3-yl(1-benzofuran-3-yl)methanone
CID 171945810
9-azabicyclo[3.3.1]nonan-3-yl(1-benzofuran-3-yl)methanone
CID 171945820
1-benzofuran-3-yl(morpholin-3-yl)methanone
CID 116919658
1-benzofuran-3-yl-(9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl)methanone
CID 171945822
2,3-dihydro-1H-inden-2-yl(furan-2-yl)methanone
CID 65408377
2,3-dihydro-1H-inden-2-yl-(1-methylindol-3-yl)methanone
CID 106892551
2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone
CID 106893079
1-benzofuran-3-yl-(1-methylcyclopropyl)methanone
CID 164656337
cyclopropyl-(5-hydroxy-1-benzofuran-3-yl)methanone
CID 760965
3-[1-benzofuran-3-yl-(4-chlorophenyl)methylidene]cyclobutane-1-carboxylic acid
CID 175382134
2-amino-1-(1-benzofuran-3-yl)-2-methylpropan-1-one
CID 116915418

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone?
The IUPAC name of 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone (CID 106893049) is 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone.
What is the SMILES notation for 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone?
The canonical SMILES for 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone is O=C(c1coc2ccccc12)C1Cc2ccccc2C1.
What is the InChIKey of 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone?
The InChIKey is WSQMBVHIRMLVNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O2/c19-18(14-9-12-5-1-2-6-13(12)10-14)16-11-20-17-8-4-3-7-15(16)17/h1-8,11,14H,9-10H2.
What are the key properties of 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone?
1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone has a molecular weight of 262.31 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-3-yl(2,3-dihydro-1H-inden-2-yl)methanone is sourced from PubChem (CID 106893049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).