1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone

C15H18O — CID 64982201

IUPAC1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone
SMILESO=C(Cc1ccc2c(c1)CCC2)C1CCC1
InChIInChI=1S/C15H18O/c16-15(13-4-2-5-13)10-11-7-8-12-3-1-6-14(12)9-11/h7-9,13H,1-6,10H2
InChIKeyVERFZYCHNYTMKT-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.09
Rot. Bonds3

About 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone

1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone (PubChem CID 64982201) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone.

Molecular Properties

Compound Name1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone
PubChem CID64982201
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Name1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone
SMILESO=C(Cc1ccc2c(c1)CCC2)C1CCC1
InChIInChI=1S/C15H18O/c16-15(13-4-2-5-13)10-11-7-8-12-3-1-6-14(12)9-11/h7-9,13H,1-6,10H2
InChIKeyVERFZYCHNYTMKT-UHFFFAOYSA-N
XLogP3.09
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylcyclopropyl)ethanone
CID 65420155
2-(2,3-dihydro-1H-inden-5-yl)-1-(thiolan-2-yl)ethanone
CID 80622050
N-cyclopropyl-2-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 8623360
2-(2,3-dihydro-1H-inden-5-yl)-1-[4-(3-methylpentan-3-ylsulfonylmethyl)cyclohexyl]ethanone
CID 58144883
N-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]cyclobutanecarboxamide
CID 110787783
2-(4-chlorophenyl)-1-cyclobutylethanone
CID 61077692
1-cyclobutyl-2-(4-methylphenyl)ethanone
CID 61080102
1-(7-azabicyclo[2.2.1]heptan-2-yl)-2-(2,3-dihydro-1H-inden-5-yl)ethanone
CID 116576079
3-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 66030527
cis-(1R,3S)-3-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 106320641
3-amino-3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-yl)butan-2-one
CID 116558583
2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 25653

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone?
The IUPAC name of 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone (CID 64982201) is 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone.
What is the SMILES notation for 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone?
The canonical SMILES for 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone is O=C(Cc1ccc2c(c1)CCC2)C1CCC1.
What is the InChIKey of 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone?
The InChIKey is VERFZYCHNYTMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c16-15(13-4-2-5-13)10-11-7-8-12-3-1-6-14(12)9-11/h7-9,13H,1-6,10H2.
What are the key properties of 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone?
1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone has a molecular weight of 214.31 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-(2,3-dihydro-1H-inden-5-yl)ethanone is sourced from PubChem (CID 64982201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).