4-ethyl-3-hydroxy-1,3-dihydroindol-2-one

C10H11NO2 — CID 53484480

IUPAC4-ethyl-3-hydroxy-1,3-dihydroindol-2-one
SMILESCCc1cccc2c1C(O)C(=O)N2
InChIInChI=1S/C10H11NO2/c1-2-6-4-3-5-7-8(6)9(12)10(13)11-7/h3-5,9,12H,2H2,1H3,(H,11,13)
InChIKeyOWEFVBZYSIRPRG-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.23
Rot. Bonds1

About 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one

4-ethyl-3-hydroxy-1,3-dihydroindol-2-one (PubChem CID 53484480) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name4-ethyl-3-hydroxy-1,3-dihydroindol-2-one
PubChem CID53484480
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name4-ethyl-3-hydroxy-1,3-dihydroindol-2-one
SMILESCCc1cccc2c1C(O)C(=O)N2
InChIInChI=1S/C10H11NO2/c1-2-6-4-3-5-7-8(6)9(12)10(13)11-7/h3-5,9,12H,2H2,1H3,(H,11,13)
InChIKeyOWEFVBZYSIRPRG-UHFFFAOYSA-N
XLogP1.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Dihydro-3-hydroxy-3-(2-oxopropyl)-2H-indol-2-one
CID 36460
3-Hydroxy-3-phenyl-1,3-dihydroindol-2-one
CID 15806
3-Hydroxy-3-methyloxindole
CID 151066
Dioxindole
CID 6097
(-)-3-Cyanomethyl-3-hydroxy-1H-indol-2(3H)-one
CID 11658413
3-Hydroxy-3-(trifluoromethyl)indolin-2-one
CID 2801696
3-Allyl-3-hydroxy-1,3-dihydro-indol-2-one
CID 646528
Mls003115172
CID 314749
Mandelanilide
CID 346169
5-bromo-3-hydroxy-2,3-dihydro-1H-indol-2-one
CID 2804937
diethyl (3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)phosphonate
CID 2881738
3-Hydroxy-3-(2-oxocycloheptyl)indolin-2-one
CID 3108852

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one?
The IUPAC name of 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one (CID 53484480) is 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one.
What is the SMILES notation for 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one?
The canonical SMILES for 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one is CCc1cccc2c1C(O)C(=O)N2.
What is the InChIKey of 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one?
The InChIKey is OWEFVBZYSIRPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-2-6-4-3-5-7-8(6)9(12)10(13)11-7/h3-5,9,12H,2H2,1H3,(H,11,13).
What are the key properties of 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one?
4-ethyl-3-hydroxy-1,3-dihydroindol-2-one has a molecular weight of 177.20 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-hydroxy-1,3-dihydroindol-2-one is sourced from PubChem (CID 53484480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).