(3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one

C17H14N2O3 — CID 92733868

IUPAC(3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one
SMILESCOc1ccc2c(c1)[C@](O)(c1c[nH]c3ccccc13)C(=O)N2
InChIInChI=1S/C17H14N2O3/c1-22-10-6-7-15-12(8-10)17(21,16(20)19-15)13-9-18-14-5-3-2-4-11(13)14/h2-9,18,21H,1H3,(H,19,20)/t17-/m0/s1
InChIKeyCZZGAFTVHYMSTL-KRWDZBQOSA-N
MW294.31 g/mol
LogP2.36
Rot. Bonds2

About (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one

(3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one (PubChem CID 92733868) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one.

Molecular Properties

Compound Name(3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one
PubChem CID92733868
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name(3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one
SMILESCOc1ccc2c(c1)[C@](O)(c1c[nH]c3ccccc13)C(=O)N2
InChIInChI=1S/C17H14N2O3/c1-22-10-6-7-15-12(8-10)17(21,16(20)19-15)13-9-18-14-5-3-2-4-11(13)14/h2-9,18,21H,1H3,(H,19,20)/t17-/m0/s1
InChIKeyCZZGAFTVHYMSTL-KRWDZBQOSA-N
XLogP2.36
TPSA74.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-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

3-hydroxy-3-(1H-indol-3-yl)-5-(trifluoromethoxy)-1H-indol-2-one
CID 118710075
3-hydroxy-5-iodo-3-(5-methoxy-1H-indol-3-yl)-1H-indol-2-one
CID 118710079
(3S)-3-hydroxy-3-(1H-indol-3-yl)-1H-indol-2-one
CID 757506
3-hydroxy-3-(2-hydroxy-5-methoxyphenyl)-1H-indol-2-one
CID 15857499
3-(2-fluoro-5-methoxyphenyl)-3-hydroxy-1H-indol-2-one
CID 163232497
5-chloro-3-hydroxy-3-(3-methoxyphenyl)-1H-indol-2-one
CID 22560825
(3R)-3-hydroxy-3-(2-methoxyphenyl)-1H-indol-2-one
CID 7333204
3-hydroxy-5-methoxy-3-(2-naphthalen-2-yl-2-oxoethyl)-1H-indol-2-one
CID 2976940
3-hydroxy-5-methoxy-3-[2-(4-methoxyphenyl)-2-oxoethyl]-1H-indol-2-one
CID 3699611
1-[(3aS,8bS)-4-acetyl-8b-(1H-indol-3-yl)-7-methoxy-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-3-yl]ethanone
CID 101155201
3-chloro-5-methoxy-3-methylsulfanyl-1H-indol-2-one
CID 24974230
1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol
CID 142739880

Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one?
The IUPAC name of (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one (CID 92733868) is (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one.
What is the SMILES notation for (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one?
The canonical SMILES for (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one is COc1ccc2c(c1)[C@](O)(c1c[nH]c3ccccc13)C(=O)N2.
What is the InChIKey of (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one?
The InChIKey is CZZGAFTVHYMSTL-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-22-10-6-7-15-12(8-10)17(21,16(20)19-15)13-9-18-14-5-3-2-4-11(13)14/h2-9,18,21H,1H3,(H,19,20)/t17-/m0/s1.
What are the key properties of (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one?
(3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one has a molecular weight of 294.31 g/mol, XLogP of 2.36, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-3-(1H-indol-3-yl)-5-methoxy-1H-indol-2-one is sourced from PubChem (CID 92733868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).