1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone

C19H17NO2 — CID 2080542

IUPAC1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone
SMILESCc1ccc2c(CC(=O)N3CCc4ccccc43)coc2c1
InChIInChI=1S/C19H17NO2/c1-13-6-7-16-15(12-22-18(16)10-13)11-19(21)20-9-8-14-4-2-3-5-17(14)20/h2-7,10,12H,8-9,11H2,1H3
InChIKeyBXOLEALNVMAQOZ-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.87
Rot. Bonds2

About 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone

1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone (PubChem CID 2080542) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone
PubChem CID2080542
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone
SMILESCc1ccc2c(CC(=O)N3CCc4ccccc43)coc2c1
InChIInChI=1S/C19H17NO2/c1-13-6-7-16-15(12-22-18(16)10-13)11-19(21)20-9-8-14-4-2-3-5-17(14)20/h2-7,10,12H,8-9,11H2,1H3
InChIKeyBXOLEALNVMAQOZ-UHFFFAOYSA-N
XLogP3.87
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Benzofuran-2-yl(indolin-1-yl)methanone
CID 780029
1-[4-(4-Methoxyphenyl)piperazin-1-yl]-2-(6-methyl-1-benzofuran-3-yl)ethanone
CID 2467896
2-(6-Methyl-1-benzofuran-3-yl)-1-(4-phenylpiperazin-1-yl)ethanone
CID 2546081
2,3-Dihydroindol-1-yl-[3-(methoxymethyl)-1-benzofuran-2-yl]methanone
CID 7958162
N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 9328527
(3-Methyl-1-benzofuran-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 16293355
3-[2-(furan-2-yl)-2-oxoethyl]-3-hydroxy-1-(2-phenylethyl)-1,3-dihydro-2H-indol-2-one
CID 3798162
1-[(3-Methyl-1-benzofuran-2-yl)carbonyl]indoline
CID 1247770
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 2081485
2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-(2,5-dimethylphenyl)acetamide
CID 2413310
2-(6-methyl-1-benzofuran-3-yl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 2534967
N-(2-ethoxyphenyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 2590975

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone?
The IUPAC name of 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone (CID 2080542) is 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone.
What is the SMILES notation for 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone?
The canonical SMILES for 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone is Cc1ccc2c(CC(=O)N3CCc4ccccc43)coc2c1.
What is the InChIKey of 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone?
The InChIKey is BXOLEALNVMAQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-13-6-7-16-15(12-22-18(16)10-13)11-19(21)20-9-8-14-4-2-3-5-17(14)20/h2-7,10,12H,8-9,11H2,1H3.
What are the key properties of 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone?
1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone has a molecular weight of 291.35 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydroindol-1-yl)-2-(6-methyl-1-benzofuran-3-yl)ethanone is sourced from PubChem (CID 2080542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).