2-(2-hydroxy-1H-indol-3-yl)indol-3-one

C16H10N2O2 — CID 10177

IUPAC2-(2-hydroxy-1H-indol-3-yl)indol-3-one
SMILESO=C1C(c2c(O)[nH]c3ccccc23)=Nc2ccccc21
InChIInChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,18,20H
InChIKeyJNLNPCNGMHKCKO-UHFFFAOYSA-N
MW262.27 g/mol
LogP3.19
Rot. Bonds1

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

2-(2-hydroxy-1H-indol-3-yl)indol-3-one (PubChem CID 10177) has the molecular formula C16H10N2O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 2-(2-hydroxy-1H-indol-3-yl)indol-3-one.

Molecular Properties

Compound Name2-(2-hydroxy-1H-indol-3-yl)indol-3-one
PubChem CID10177
Molecular FormulaC16H10N2O2
Molecular Weight262.27 g/mol
Exact Mass262.07
IUPAC Name2-(2-hydroxy-1H-indol-3-yl)indol-3-one
SMILESO=C1C(c2c(O)[nH]c3ccccc23)=Nc2ccccc21
InChIInChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,18,20H
InChIKeyJNLNPCNGMHKCKO-UHFFFAOYSA-N
XLogP3.19
TPSA65.45 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-1H-indol-3-yl)indol-3-one?
The IUPAC name of 2-(2-hydroxy-1H-indol-3-yl)indol-3-one (CID 10177) is 2-(2-hydroxy-1H-indol-3-yl)indol-3-one.
What is the SMILES notation for 2-(2-hydroxy-1H-indol-3-yl)indol-3-one?
The canonical SMILES for 2-(2-hydroxy-1H-indol-3-yl)indol-3-one is O=C1C(c2c(O)[nH]c3ccccc23)=Nc2ccccc21.
What is the InChIKey of 2-(2-hydroxy-1H-indol-3-yl)indol-3-one?
The InChIKey is JNLNPCNGMHKCKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2/c19-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)20/h1-8,18,20H.
What are the key properties of 2-(2-hydroxy-1H-indol-3-yl)indol-3-one?
2-(2-hydroxy-1H-indol-3-yl)indol-3-one has a molecular weight of 262.27 g/mol, XLogP of 3.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-1H-indol-3-yl)indol-3-one is sourced from PubChem (CID 10177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).