8H-pyrano[2,3-b]pyridine-4,7-dione

C8H5NO3 — CID 87549805

IUPAC8H-pyrano[2,3-b]pyridine-4,7-dione
SMILESO=c1ccc2c(=O)ccoc2[nH]1
InChIInChI=1S/C8H5NO3/c10-6-3-4-12-8-5(6)1-2-7(11)9-8/h1-4H,(H,9,11)
InChIKeyRFVFERPTWASVPD-UHFFFAOYSA-N
MW163.13 g/mol
LogP0.48
Rot. Bonds

About 8H-pyrano[2,3-b]pyridine-4,7-dione

8H-pyrano[2,3-b]pyridine-4,7-dione (PubChem CID 87549805) has the molecular formula C8H5NO3 and a molecular weight of 163.13 g/mol. Its IUPAC name is 8H-pyrano[2,3-b]pyridine-4,7-dione.

Molecular Properties

Compound Name8H-pyrano[2,3-b]pyridine-4,7-dione
PubChem CID87549805
Molecular FormulaC8H5NO3
Molecular Weight163.13 g/mol
Exact Mass163.03
IUPAC Name8H-pyrano[2,3-b]pyridine-4,7-dione
SMILESO=c1ccc2c(=O)ccoc2[nH]1
InChIInChI=1S/C8H5NO3/c10-6-3-4-12-8-5(6)1-2-7(11)9-8/h1-4H,(H,9,11)
InChIKeyRFVFERPTWASVPD-UHFFFAOYSA-N
XLogP0.48
TPSA63.07 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.13
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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azane;chromen-4-one
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CID 135371860
ethane;5-methyl-1H-1,6-naphthyridin-2-one
CID 143136262
6-chloro-5-methoxy-1H-quinolin-2-one
CID 59141010
7-phenylchromen-4-one
CID 57034493
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Frequently Asked Questions

What is the IUPAC name of 8H-pyrano[2,3-b]pyridine-4,7-dione?
The IUPAC name of 8H-pyrano[2,3-b]pyridine-4,7-dione (CID 87549805) is 8H-pyrano[2,3-b]pyridine-4,7-dione.
What is the SMILES notation for 8H-pyrano[2,3-b]pyridine-4,7-dione?
The canonical SMILES for 8H-pyrano[2,3-b]pyridine-4,7-dione is O=c1ccc2c(=O)ccoc2[nH]1.
What is the InChIKey of 8H-pyrano[2,3-b]pyridine-4,7-dione?
The InChIKey is RFVFERPTWASVPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NO3/c10-6-3-4-12-8-5(6)1-2-7(11)9-8/h1-4H,(H,9,11).
What are the key properties of 8H-pyrano[2,3-b]pyridine-4,7-dione?
8H-pyrano[2,3-b]pyridine-4,7-dione has a molecular weight of 163.13 g/mol, XLogP of 0.48, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8H-pyrano[2,3-b]pyridine-4,7-dione is sourced from PubChem (CID 87549805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).