2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one

C15H9N3O2 — CID 135911864

IUPAC2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one
SMILESO=C1C(c2c(O)[nH]c3ncccc23)=Nc2ccccc21
InChIInChI=1S/C15H9N3O2/c19-13-8-4-1-2-6-10(8)17-12(13)11-9-5-3-7-16-14(9)18-15(11)20/h1-7,20H,(H,16,18)
InChIKeyKTBMVPOCBCWAHE-UHFFFAOYSA-N
MW263.26 g/mol
LogP2.59
Rot. Bonds1

About 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one

2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one (PubChem CID 135911864) has the molecular formula C15H9N3O2 and a molecular weight of 263.26 g/mol. Its IUPAC name is 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one.

Molecular Properties

Compound Name2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one
PubChem CID135911864
Molecular FormulaC15H9N3O2
Molecular Weight263.26 g/mol
Exact Mass263.07
IUPAC Name2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one
SMILESO=C1C(c2c(O)[nH]c3ncccc23)=Nc2ccccc21
InChIInChI=1S/C15H9N3O2/c19-13-8-4-1-2-6-10(8)17-12(13)11-9-5-3-7-16-14(9)18-15(11)20/h1-7,20H,(H,16,18)
InChIKeyKTBMVPOCBCWAHE-UHFFFAOYSA-N
XLogP2.59
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(7-chloro-2-hydroxy-1H-indol-3-yl)indol-3-one
CID 135423851
2-(3-hydroxy-1H-indol-2-yl)indol-3-one
CID 10215
2-(3-oxoindol-2-yl)indol-3-one
CID 11858820
2-(5-hydroxy-2-oxo-1,3-dihydroimidazol-4-yl)indol-3-one
CID 3843472
N-(2-aminoethyl)-2-[2-hydroxy-3-(3-oxoindol-2-yl)-1H-indol-5-yl]acetamide
CID 135469095
2-(2-hydroxy-5-methyl-1H-indol-3-yl)pyrrolo[2,3-b]pyridin-3-one
CID 135878278
2-[2-hydroxy-6-(trifluoromethyl)-1H-indol-3-yl]pyrrolo[2,3-b]pyridin-3-one
CID 135878283
2-(2-hydroxy-5-methoxy-1H-indol-3-yl)pyrrolo[2,3-b]pyridin-3-one
CID 135927736
5-fluoro-2-(5-fluoro-2-hydroxy-1H-indol-3-yl)indol-3-one
CID 135873274
2-(4-bromophenyl)indol-3-one
CID 2312809
2-[2-hydroxy-1-(piperidine-1-carbonyl)indol-3-yl]indol-3-one
CID 168852584
2-[2-(3,5-dichlorophenyl)-3-hydroxy-5-oxo-1H-pyrazol-4-yl]indol-3-one
CID 1334022

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one?
The IUPAC name of 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one (CID 135911864) is 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one.
What is the SMILES notation for 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one?
The canonical SMILES for 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one is O=C1C(c2c(O)[nH]c3ncccc23)=Nc2ccccc21.
What is the InChIKey of 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one?
The InChIKey is KTBMVPOCBCWAHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N3O2/c19-13-8-4-1-2-6-10(8)17-12(13)11-9-5-3-7-16-14(9)18-15(11)20/h1-7,20H,(H,16,18).
What are the key properties of 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one?
2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one has a molecular weight of 263.26 g/mol, XLogP of 2.59, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-1H-pyrrolo[2,3-b]pyridin-3-yl)indol-3-one is sourced from PubChem (CID 135911864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).