1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone

C18H18O — CID 65407423

IUPAC1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone
SMILESCc1ccccc1CC(=O)C1CCc2ccccc21
InChIInChI=1S/C18H18O/c1-13-6-2-3-8-15(13)12-18(19)17-11-10-14-7-4-5-9-16(14)17/h2-9,17H,10-12H2,1H3
InChIKeyQCDMMNZPWFOCPC-UHFFFAOYSA-N
MW250.34 g/mol
LogP3.84
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone

1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone (PubChem CID 65407423) has the molecular formula C18H18O and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone
PubChem CID65407423
Molecular FormulaC18H18O
Molecular Weight250.34 g/mol
Exact Mass250.14
IUPAC Name1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone
SMILESCc1ccccc1CC(=O)C1CCc2ccccc21
InChIInChI=1S/C18H18O/c1-13-6-2-3-8-15(13)12-18(19)17-11-10-14-7-4-5-9-16(14)17/h2-9,17H,10-12H2,1H3
InChIKeyQCDMMNZPWFOCPC-UHFFFAOYSA-N
XLogP3.84
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-difluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethanone
CID 65406653
1-(2,3-dihydro-1H-inden-1-yl)-2-(3-methylphenyl)ethanone
CID 65408183
2-cyclopropyl-1-(2,3-dihydro-1H-inden-1-yl)ethanone
CID 65407992
1-cyclopropyl-2-(2-methylphenyl)ethanone
CID 39236490
1-(2,3-dihydro-1H-inden-1-yl)-4-methylsulfonylbutan-1-one
CID 65407807
2,3-dihydro-1H-inden-1-yl-(4-methylphenyl)methanone
CID 65408196
cadmium;bis(2,3-dihydro-1H-indene-1-carboxylic acid)
CID 162540344
1-(2,3-dihydro-1H-inden-1-yl)-3-thiophen-3-ylpropan-1-one
CID 65407812
2-(3-chloro-4-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethanone
CID 103039403
1-(2,3-dihydro-1H-inden-1-yl)-3-(4-methoxyphenyl)propan-1-one
CID 65446449
1-(2,3-dihydro-1H-inden-1-yl)-2-(1-propylimidazol-2-yl)ethanone
CID 79744199
2-(2-methylphenyl)acetic acid
CID 67440217

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone?
The IUPAC name of 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone (CID 65407423) is 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone is Cc1ccccc1CC(=O)C1CCc2ccccc21.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone?
The InChIKey is QCDMMNZPWFOCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O/c1-13-6-2-3-8-15(13)12-18(19)17-11-10-14-7-4-5-9-16(14)17/h2-9,17H,10-12H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone?
1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone has a molecular weight of 250.34 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-1-yl)-2-(2-methylphenyl)ethanone is sourced from PubChem (CID 65407423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).