7H-furo[3,4-b]pyridin-5-one

C7H5NO2 — CID 819439

IUPAC7H-furo[3,4-b]pyridin-5-one
SMILESO=C1OCc2ncccc21
InChIInChI=1S/C7H5NO2/c9-7-5-2-1-3-8-6(5)4-10-7/h1-3H,4H2
InChIKeyYSJHADWSLVFGGT-UHFFFAOYSA-N
MW135.12 g/mol
LogP0.75
Rot. Bonds

About 7H-furo[3,4-b]pyridin-5-one

7H-furo[3,4-b]pyridin-5-one (PubChem CID 819439) has the molecular formula C7H5NO2 and a molecular weight of 135.12 g/mol. Its IUPAC name is 7H-furo[3,4-b]pyridin-5-one.

Molecular Properties

Compound Name7H-furo[3,4-b]pyridin-5-one
PubChem CID819439
Molecular FormulaC7H5NO2
Molecular Weight135.12 g/mol
Exact Mass135.03
IUPAC Name7H-furo[3,4-b]pyridin-5-one
SMILESO=C1OCc2ncccc21
InChIInChI=1S/C7H5NO2/c9-7-5-2-1-3-8-6(5)4-10-7/h1-3H,4H2
InChIKeyYSJHADWSLVFGGT-UHFFFAOYSA-N
XLogP0.75
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.12
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7H-furo[3,4-b]pyridin-5-one?
The IUPAC name of 7H-furo[3,4-b]pyridin-5-one (CID 819439) is 7H-furo[3,4-b]pyridin-5-one.
What is the SMILES notation for 7H-furo[3,4-b]pyridin-5-one?
The canonical SMILES for 7H-furo[3,4-b]pyridin-5-one is O=C1OCc2ncccc21.
What is the InChIKey of 7H-furo[3,4-b]pyridin-5-one?
The InChIKey is YSJHADWSLVFGGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NO2/c9-7-5-2-1-3-8-6(5)4-10-7/h1-3H,4H2.
What are the key properties of 7H-furo[3,4-b]pyridin-5-one?
7H-furo[3,4-b]pyridin-5-one has a molecular weight of 135.12 g/mol, XLogP of 0.75, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7H-furo[3,4-b]pyridin-5-one is sourced from PubChem (CID 819439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).