1-ethyl-3-hydroxy-3-phenylindol-2-one

C16H15NO2 — CID 15064087

IUPAC1-ethyl-3-hydroxy-3-phenylindol-2-one
SMILESCCN1C(=O)C(O)(c2ccccc2)c2ccccc21
InChIInChI=1S/C16H15NO2/c1-2-17-14-11-7-6-10-13(14)16(19,15(17)18)12-8-4-3-5-9-12/h3-11,19H,2H2,1H3
InChIKeyIKOJRJIUPYJHSG-UHFFFAOYSA-N
MW253.30 g/mol
LogP2.29
Rot. Bonds2

About 1-ethyl-3-hydroxy-3-phenylindol-2-one

1-ethyl-3-hydroxy-3-phenylindol-2-one (PubChem CID 15064087) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 1-ethyl-3-hydroxy-3-phenylindol-2-one.

Molecular Properties

Compound Name1-ethyl-3-hydroxy-3-phenylindol-2-one
PubChem CID15064087
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name1-ethyl-3-hydroxy-3-phenylindol-2-one
SMILESCCN1C(=O)C(O)(c2ccccc2)c2ccccc21
InChIInChI=1S/C16H15NO2/c1-2-17-14-11-7-6-10-13(14)16(19,15(17)18)12-8-4-3-5-9-12/h3-11,19H,2H2,1H3
InChIKeyIKOJRJIUPYJHSG-UHFFFAOYSA-N
XLogP2.29
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-3-hydroxy-3-phenylindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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
(-)-3-Cyanomethyl-3-hydroxy-1H-indol-2(3H)-one
CID 11658413
3-Hydroxy-3-(trifluoromethyl)indolin-2-one
CID 2801696
4-Hydroxy-1-methyl-3-phenyl-1,2-dihydroquinolin-2-one
CID 54680431
3-Hydroxy-2-(2-methylphenyl)isoindolin-1-one
CID 20854937
3-Allyl-3-hydroxy-1,3-dihydro-indol-2-one
CID 646528
3-Benzyl-4-hydroxy-1-methylquinolin-2(1H)-one
CID 54705756
3-Hydroxy-3-phenacyloxindole
CID 99051
Mls003115172
CID 314749
1-Acetyl-3-hydroxy-5-methyl-3-(trifluoromethyl)indolin-2-one
CID 49769449

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-hydroxy-3-phenylindol-2-one?
The IUPAC name of 1-ethyl-3-hydroxy-3-phenylindol-2-one (CID 15064087) is 1-ethyl-3-hydroxy-3-phenylindol-2-one.
What is the SMILES notation for 1-ethyl-3-hydroxy-3-phenylindol-2-one?
The canonical SMILES for 1-ethyl-3-hydroxy-3-phenylindol-2-one is CCN1C(=O)C(O)(c2ccccc2)c2ccccc21.
What is the InChIKey of 1-ethyl-3-hydroxy-3-phenylindol-2-one?
The InChIKey is IKOJRJIUPYJHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-2-17-14-11-7-6-10-13(14)16(19,15(17)18)12-8-4-3-5-9-12/h3-11,19H,2H2,1H3.
What are the key properties of 1-ethyl-3-hydroxy-3-phenylindol-2-one?
1-ethyl-3-hydroxy-3-phenylindol-2-one has a molecular weight of 253.30 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-hydroxy-3-phenylindol-2-one is sourced from PubChem (CID 15064087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).