5-ethylindol-2-one

C10H9NO — CID 23212401

IUPAC5-ethylindol-2-one
SMILESCCc1ccc2c(c1)=CC(=O)N=2
InChIInChI=1S/C10H9NO/c1-2-7-3-4-9-8(5-7)6-10(12)11-9/h3-6H,2H2,1H3
InChIKeyCQCQFSKLXIFSAS-UHFFFAOYSA-N
MW159.19 g/mol
LogP0.19
Rot. Bonds1

About 5-ethylindol-2-one

5-ethylindol-2-one (PubChem CID 23212401) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 5-ethylindol-2-one.

Molecular Properties

Compound Name5-ethylindol-2-one
PubChem CID23212401
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name5-ethylindol-2-one
SMILESCCc1ccc2c(c1)=CC(=O)N=2
InChIInChI=1S/C10H9NO/c1-2-7-3-4-9-8(5-7)6-10(12)11-9/h3-6H,2H2,1H3
InChIKeyCQCQFSKLXIFSAS-UHFFFAOYSA-N
XLogP0.19
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Indol-2-one
CID 17904787
6-Bromoindole-2-one
CID 22038270
1-Benzazepin-2-one
CID 20244764
Fluoro-indolone
CID 54356889
5-Chloroindole-2-one
CID 20284810
5-Bromoindol-2-one
CID 46739842
6-Chloroindole-2-one
CID 46739848
4,7-Ditert-butylazepin-2-one
CID 10584976
Benzazoninone
CID 20269004
Cyclopenta[c]quinolin-4-one
CID 20502643
3-Methyl-oxoindole
CID 21477845
Indolone-1-oxide
CID 21665805

Frequently Asked Questions

What is the IUPAC name of 5-ethylindol-2-one?
The IUPAC name of 5-ethylindol-2-one (CID 23212401) is 5-ethylindol-2-one.
What is the SMILES notation for 5-ethylindol-2-one?
The canonical SMILES for 5-ethylindol-2-one is CCc1ccc2c(c1)=CC(=O)N=2.
What is the InChIKey of 5-ethylindol-2-one?
The InChIKey is CQCQFSKLXIFSAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c1-2-7-3-4-9-8(5-7)6-10(12)11-9/h3-6H,2H2,1H3.
What are the key properties of 5-ethylindol-2-one?
5-ethylindol-2-one has a molecular weight of 159.19 g/mol, XLogP of 0.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylindol-2-one is sourced from PubChem (CID 23212401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).