(3R)-3-hydroxy-1,3-dimethylindol-2-one

C10H11NO2 — CID 102086681

IUPAC(3R)-3-hydroxy-1,3-dimethylindol-2-one
SMILESCN1C(=O)[C@](C)(O)c2ccccc21
InChIInChI=1S/C10H11NO2/c1-10(13)7-5-3-4-6-8(7)11(2)9(10)12/h3-6,13H,1-2H3/t10-/m1/s1
InChIKeyKKYJEHMJKVIBOB-SNVBAGLBSA-N
MW177.20 g/mol
LogP0.87
Rot. Bonds

About (3R)-3-hydroxy-1,3-dimethylindol-2-one

(3R)-3-hydroxy-1,3-dimethylindol-2-one (PubChem CID 102086681) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is (3R)-3-hydroxy-1,3-dimethylindol-2-one.

Molecular Properties

Compound Name(3R)-3-hydroxy-1,3-dimethylindol-2-one
PubChem CID102086681
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name(3R)-3-hydroxy-1,3-dimethylindol-2-one
SMILESCN1C(=O)[C@](C)(O)c2ccccc21
InChIInChI=1S/C10H11NO2/c1-10(13)7-5-3-4-6-8(7)11(2)9(10)12/h3-6,13H,1-2H3/t10-/m1/s1
InChIKeyKKYJEHMJKVIBOB-SNVBAGLBSA-N
XLogP0.87
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R)-3-hydroxy-1,3-dimethylindol-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

11-hydroxy-5,11-dimethylbenzo[c][1]benzazepin-6-one
CID 14203513
1,3,3,4,4-pentamethylquinolin-2-one
CID 57425073
(3R)-3-hydroxy-1-methyl-3-(trifluoromethyl)indol-2-one
CID 92845660
3-acetyl-1,3-dimethylindol-2-one
CID 71513470
9,9,10-trimethylacridine
CID 610451
3-ethyl-1,3-dimethylindol-2-one
CID 14449303
1,3',3'-trimethylspiro[indole-3,2'-oxirane]-2-one
CID 102309588
(3S)-3-[(3S)-3-fluoro-1-methyl-2-oxoindol-3-yl]-3-hydroxy-1-methylindol-2-one
CID 139095917
1'-methylspiro[cyclopropane-1,3'-indole]-2'-one
CID 14317864
2-[(3R)-1,3-dimethyl-2-oxoindol-3-yl]acetic acid
CID 167685372
3-hydroxy-3-methyl-1-prop-2-enylindol-2-one
CID 177313716
3-anilino-1,3-dimethylindol-2-one
CID 71527226

Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-1,3-dimethylindol-2-one?
The IUPAC name of (3R)-3-hydroxy-1,3-dimethylindol-2-one (CID 102086681) is (3R)-3-hydroxy-1,3-dimethylindol-2-one.
What is the SMILES notation for (3R)-3-hydroxy-1,3-dimethylindol-2-one?
The canonical SMILES for (3R)-3-hydroxy-1,3-dimethylindol-2-one is CN1C(=O)[C@](C)(O)c2ccccc21.
What is the InChIKey of (3R)-3-hydroxy-1,3-dimethylindol-2-one?
The InChIKey is KKYJEHMJKVIBOB-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11NO2/c1-10(13)7-5-3-4-6-8(7)11(2)9(10)12/h3-6,13H,1-2H3/t10-/m1/s1.
What are the key properties of (3R)-3-hydroxy-1,3-dimethylindol-2-one?
(3R)-3-hydroxy-1,3-dimethylindol-2-one has a molecular weight of 177.20 g/mol, XLogP of 0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-1,3-dimethylindol-2-one is sourced from PubChem (CID 102086681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).