4-hydroxy-3-iodo-1H-pyridin-2-one

C5H4INO2 — CID 54719033

IUPAC4-hydroxy-3-iodo-1H-pyridin-2-one
SMILESO=c1[nH]ccc(O)c1I
InChIInChI=1S/C5H4INO2/c6-4-3(8)1-2-7-5(4)9/h1-2H,(H2,7,8,9)
InChIKeyZMZBTVNJAFUGHG-UHFFFAOYSA-N
MW237.00 g/mol
LogP0.69
Rot. Bonds

About 4-hydroxy-3-iodo-1H-pyridin-2-one

4-hydroxy-3-iodo-1H-pyridin-2-one (PubChem CID 54719033) has the molecular formula C5H4INO2 and a molecular weight of 237.00 g/mol. Its IUPAC name is 4-hydroxy-3-iodo-1H-pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-3-iodo-1H-pyridin-2-one
PubChem CID54719033
Molecular FormulaC5H4INO2
Molecular Weight237.00 g/mol
Exact Mass236.93
IUPAC Name4-hydroxy-3-iodo-1H-pyridin-2-one
SMILESO=c1[nH]ccc(O)c1I
InChIInChI=1S/C5H4INO2/c6-4-3(8)1-2-7-5(4)9/h1-2H,(H2,7,8,9)
InChIKeyZMZBTVNJAFUGHG-UHFFFAOYSA-N
XLogP0.69
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.00
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

4-Hydroxy-2(1H)-pyridinone
CID 54696004
3-Chloro-4-hydroxypyridin-2(1H)-one
CID 54682528
3,4-Dihydroxypyridin-2(1H)-one
CID 54707960
3-Bromo-4-hydroxypyridin-2(1h)-one
CID 54715668
4-Hydroxy-3-methyl-2(1H)-pyridinone
CID 54723665
5-Fluoro-4-hydroxypyridin-2(1H)-one
CID 54703956
3-fluoro-4-hydroxy-1H-pyridin-2-one
CID 68536861
3-Sulfanyl-4-hydroxypyridone
CID 90848289
4-hydroxy-5-iodo-1H-pyridin-2-one
CID 58054029
CID 87786263
CID 87786263
ethane;4-hydroxy-1H-pyridin-2-one
CID 144155426
(3E,5Z,7Z)-4-hydroxy-1H-azocin-2-one
CID 144623389

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-iodo-1H-pyridin-2-one?
The IUPAC name of 4-hydroxy-3-iodo-1H-pyridin-2-one (CID 54719033) is 4-hydroxy-3-iodo-1H-pyridin-2-one.
What is the SMILES notation for 4-hydroxy-3-iodo-1H-pyridin-2-one?
The canonical SMILES for 4-hydroxy-3-iodo-1H-pyridin-2-one is O=c1[nH]ccc(O)c1I.
What is the InChIKey of 4-hydroxy-3-iodo-1H-pyridin-2-one?
The InChIKey is ZMZBTVNJAFUGHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4INO2/c6-4-3(8)1-2-7-5(4)9/h1-2H,(H2,7,8,9).
What are the key properties of 4-hydroxy-3-iodo-1H-pyridin-2-one?
4-hydroxy-3-iodo-1H-pyridin-2-one has a molecular weight of 237.00 g/mol, XLogP of 0.69, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-iodo-1H-pyridin-2-one is sourced from PubChem (CID 54719033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).