2-(3-oxoindol-2-yl)indol-3-one

C16H8N2O2 — CID 11858820

IUPAC2-(3-oxoindol-2-yl)indol-3-one
SMILESO=C1C(C2=Nc3ccccc3C2=O)=Nc2ccccc21
InChIInChI=1S/C16H8N2O2/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14/h1-8H
InChIKeyIYPVIOXAYRCAOB-UHFFFAOYSA-N
MW260.25 g/mol
LogP2.92
Rot. Bonds1

About 2-(3-oxoindol-2-yl)indol-3-one

2-(3-oxoindol-2-yl)indol-3-one (PubChem CID 11858820) has the molecular formula C16H8N2O2 and a molecular weight of 260.25 g/mol. Its IUPAC name is 2-(3-oxoindol-2-yl)indol-3-one.

Molecular Properties

Compound Name2-(3-oxoindol-2-yl)indol-3-one
PubChem CID11858820
Molecular FormulaC16H8N2O2
Molecular Weight260.25 g/mol
Exact Mass260.06
IUPAC Name2-(3-oxoindol-2-yl)indol-3-one
SMILESO=C1C(C2=Nc3ccccc3C2=O)=Nc2ccccc21
InChIInChI=1S/C16H8N2O2/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14/h1-8H
InChIKeyIYPVIOXAYRCAOB-UHFFFAOYSA-N
XLogP2.92
TPSA58.86 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.25
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Aminobenzophenone
CID 76080
3H-Indol-3-one, 2-phenyl-, 1-oxide
CID 74787
2-(4-Nitrophenyl)-1-oxido-indol-1-ium-3-one
CID 361797
2-Phenylindolone
CID 99128
Iminoquinone
CID 132942542
3H-Indol-3-one, 2-(2-methylphenyl)-, 1-oxide
CID 362360
1-(2-Aminophenyl)-3-phenylprop-2-en-1-one
CID 5965183
2-(4-Chlorophenyl)indol-3-one
CID 15261100
1-Oxido-2-(p-tolyl)indol-1-ium-3-one
CID 362362
2-(2-Methylpropyl)-1-oxidoindol-1-ium-3-one
CID 44820409
2-(4-Fluorophenyl)-3-oxo-3H-indole 1-Oxide
CID 44820411
2'-Aminochalcone
CID 356976

Frequently Asked Questions

What is the IUPAC name of 2-(3-oxoindol-2-yl)indol-3-one?
The IUPAC name of 2-(3-oxoindol-2-yl)indol-3-one (CID 11858820) is 2-(3-oxoindol-2-yl)indol-3-one.
What is the SMILES notation for 2-(3-oxoindol-2-yl)indol-3-one?
The canonical SMILES for 2-(3-oxoindol-2-yl)indol-3-one is O=C1C(C2=Nc3ccccc3C2=O)=Nc2ccccc21.
What is the InChIKey of 2-(3-oxoindol-2-yl)indol-3-one?
The InChIKey is IYPVIOXAYRCAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8N2O2/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14/h1-8H.
What are the key properties of 2-(3-oxoindol-2-yl)indol-3-one?
2-(3-oxoindol-2-yl)indol-3-one has a molecular weight of 260.25 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-oxoindol-2-yl)indol-3-one is sourced from PubChem (CID 11858820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).