4-hydroxypyrano[3,2-b]pyridin-2-one

C8H5NO3 — CID 54734203

IUPAC4-hydroxypyrano[3,2-b]pyridin-2-one
SMILESO=c1cc(O)c2ncccc2o1
InChIInChI=1S/C8H5NO3/c10-5-4-7(11)12-6-2-1-3-9-8(5)6/h1-4,10H
InChIKeyHHSOESOBCICGMY-UHFFFAOYSA-N
MW163.13 g/mol
LogP0.89
Rot. Bonds

About 4-hydroxypyrano[3,2-b]pyridin-2-one

4-hydroxypyrano[3,2-b]pyridin-2-one (PubChem CID 54734203) has the molecular formula C8H5NO3 and a molecular weight of 163.13 g/mol. Its IUPAC name is 4-hydroxypyrano[3,2-b]pyridin-2-one.

Molecular Properties

Compound Name4-hydroxypyrano[3,2-b]pyridin-2-one
PubChem CID54734203
Molecular FormulaC8H5NO3
Molecular Weight163.13 g/mol
Exact Mass163.03
IUPAC Name4-hydroxypyrano[3,2-b]pyridin-2-one
SMILESO=c1cc(O)c2ncccc2o1
InChIInChI=1S/C8H5NO3/c10-5-4-7(11)12-6-2-1-3-9-8(5)6/h1-4,10H
InChIKeyHHSOESOBCICGMY-UHFFFAOYSA-N
XLogP0.89
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.13
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxypyrano[3,2-b]pyridin-2-one?
The IUPAC name of 4-hydroxypyrano[3,2-b]pyridin-2-one (CID 54734203) is 4-hydroxypyrano[3,2-b]pyridin-2-one.
What is the SMILES notation for 4-hydroxypyrano[3,2-b]pyridin-2-one?
The canonical SMILES for 4-hydroxypyrano[3,2-b]pyridin-2-one is O=c1cc(O)c2ncccc2o1.
What is the InChIKey of 4-hydroxypyrano[3,2-b]pyridin-2-one?
The InChIKey is HHSOESOBCICGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NO3/c10-5-4-7(11)12-6-2-1-3-9-8(5)6/h1-4,10H.
What are the key properties of 4-hydroxypyrano[3,2-b]pyridin-2-one?
4-hydroxypyrano[3,2-b]pyridin-2-one has a molecular weight of 163.13 g/mol, XLogP of 0.89, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxypyrano[3,2-b]pyridin-2-one is sourced from PubChem (CID 54734203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).