3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one

C7H6N2O2 — CID 175730735

IUPAC3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
SMILESO=C1Nc2cccnc2C1O
InChIInChI=1S/C7H6N2O2/c10-6-5-4(9-7(6)11)2-1-3-8-5/h1-3,6,10H,(H,9,11)
InChIKeyIZSQVMSTULBPDG-UHFFFAOYSA-N
MW150.14 g/mol
LogP0.07
Rot. Bonds

About 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one

3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one (PubChem CID 175730735) has the molecular formula C7H6N2O2 and a molecular weight of 150.14 g/mol. Its IUPAC name is 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one.

Molecular Properties

Compound Name3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
PubChem CID175730735
Molecular FormulaC7H6N2O2
Molecular Weight150.14 g/mol
Exact Mass150.04
IUPAC Name3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
SMILESO=C1Nc2cccnc2C1O
InChIInChI=1S/C7H6N2O2/c10-6-5-4(9-7(6)11)2-1-3-8-5/h1-3,6,10H,(H,9,11)
InChIKeyIZSQVMSTULBPDG-UHFFFAOYSA-N
XLogP0.07
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one?
The IUPAC name of 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one (CID 175730735) is 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one.
What is the SMILES notation for 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one?
The canonical SMILES for 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one is O=C1Nc2cccnc2C1O.
What is the InChIKey of 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one?
The InChIKey is IZSQVMSTULBPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2/c10-6-5-4(9-7(6)11)2-1-3-8-5/h1-3,6,10H,(H,9,11).
What are the key properties of 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one?
3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one has a molecular weight of 150.14 g/mol, XLogP of 0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1,3-dihydropyrrolo[3,2-b]pyridin-2-one is sourced from PubChem (CID 175730735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).