1-(1-cyclobutylindol-2-yl)ethanone

C14H15NO — CID 115115292

IUPAC1-(1-cyclobutylindol-2-yl)ethanone
SMILESCC(=O)c1cc2ccccc2n1C1CCC1
InChIInChI=1S/C14H15NO/c1-10(16)14-9-11-5-2-3-8-13(11)15(14)12-6-4-7-12/h2-3,5,8-9,12H,4,6-7H2,1H3
InChIKeyIYGODFNWELCALG-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.57
Rot. Bonds2

About 1-(1-cyclobutylindol-2-yl)ethanone

1-(1-cyclobutylindol-2-yl)ethanone (PubChem CID 115115292) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-(1-cyclobutylindol-2-yl)ethanone.

Molecular Properties

Compound Name1-(1-cyclobutylindol-2-yl)ethanone
PubChem CID115115292
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name1-(1-cyclobutylindol-2-yl)ethanone
SMILESCC(=O)c1cc2ccccc2n1C1CCC1
InChIInChI=1S/C14H15NO/c1-10(16)14-9-11-5-2-3-8-13(11)15(14)12-6-4-7-12/h2-3,5,8-9,12H,4,6-7H2,1H3
InChIKeyIYGODFNWELCALG-UHFFFAOYSA-N
XLogP3.57
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-dimethyloxan-4-yl)indole-2-carboxylic acid
CID 13449730
1-cyclopropylindole-2-carbaldehyde
CID 115016882
2-(1-cyclopentylindol-2-yl)ethanamine
CID 115115551
(1-cyclopentylindol-2-yl)-triethylsilane
CID 167452813
9-cyclobutylcarbazole
CID 66713557
1-cyclopropyl-2-phenylindole
CID 162400669
1-(4-chlorophenyl)indole-2-carboxylic acid;1-propan-2-ylpiperidin-4-amine
CID 172769945
1-(1-cyclopentylindol-5-yl)ethanone
CID 115115492
2-cyclobutyl-N-(2,4-dimethylphenyl)-1-oxoisoquinoline-3-carboxamide
CID 171999865
1-cyclobutyl-2-cyclopropylbenzimidazole-4-carboxylic acid
CID 115543497
(1-methylindol-2-yl)-[4-(propan-2-ylamino)piperidin-1-yl]methanone
CID 90380576
2-cyclopropyl-1-oxoisoquinoline-3-carboxamide
CID 171704244

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclobutylindol-2-yl)ethanone?
The IUPAC name of 1-(1-cyclobutylindol-2-yl)ethanone (CID 115115292) is 1-(1-cyclobutylindol-2-yl)ethanone.
What is the SMILES notation for 1-(1-cyclobutylindol-2-yl)ethanone?
The canonical SMILES for 1-(1-cyclobutylindol-2-yl)ethanone is CC(=O)c1cc2ccccc2n1C1CCC1.
What is the InChIKey of 1-(1-cyclobutylindol-2-yl)ethanone?
The InChIKey is IYGODFNWELCALG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-10(16)14-9-11-5-2-3-8-13(11)15(14)12-6-4-7-12/h2-3,5,8-9,12H,4,6-7H2,1H3.
What are the key properties of 1-(1-cyclobutylindol-2-yl)ethanone?
1-(1-cyclobutylindol-2-yl)ethanone has a molecular weight of 213.28 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclobutylindol-2-yl)ethanone is sourced from PubChem (CID 115115292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).