5-fluoro-3-iodo-1H-pyridin-2-one

C5H3FINO — CID 46737827

IUPAC5-fluoro-3-iodo-1H-pyridin-2-one
SMILESO=c1[nH]cc(F)cc1I
InChIInChI=1S/C5H3FINO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9)
InChIKeyKCBSXUQSZXQHQM-UHFFFAOYSA-N
MW238.99 g/mol
LogP1.12
Rot. Bonds

About 5-fluoro-3-iodo-1H-pyridin-2-one

5-fluoro-3-iodo-1H-pyridin-2-one (PubChem CID 46737827) has the molecular formula C5H3FINO and a molecular weight of 238.99 g/mol. Its IUPAC name is 5-fluoro-3-iodo-1H-pyridin-2-one.

Molecular Properties

Compound Name5-fluoro-3-iodo-1H-pyridin-2-one
PubChem CID46737827
Molecular FormulaC5H3FINO
Molecular Weight238.99 g/mol
Exact Mass238.92
IUPAC Name5-fluoro-3-iodo-1H-pyridin-2-one
SMILESO=c1[nH]cc(F)cc1I
InChIInChI=1S/C5H3FINO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9)
InChIKeyKCBSXUQSZXQHQM-UHFFFAOYSA-N
XLogP1.12
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.99
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,5-Diiodopyridin-2-ol
CID 293093
2-Hydroxy-5-iodopyridine
CID 459500
5-Chloro-3-fluoro-2-hydroxypyridine
CID 12031535
3-Iodopyridin-2-ol
CID 13636536
3-Fluoro-2-hydroxypyridine
CID 2783363
4-Iodo-1,2-dihydropyridin-2-one
CID 20582535
5-Fluoro-2-hydroxypyridine
CID 2762864
5-Iodo-3-(trifluoromethyl)pyridin-2-ol
CID 11522099
5-Bromo-3-iodopyridin-2-ol
CID 12027787
5-Bromo-3-fluoro-1,2-dihydropyridin-2-one
CID 19387560
5-Chloro-3-iodopyridin-2-ol
CID 19597644
4-fluoro-5-iodo-1H-pyridin-2-one
CID 68110419

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-iodo-1H-pyridin-2-one?
The IUPAC name of 5-fluoro-3-iodo-1H-pyridin-2-one (CID 46737827) is 5-fluoro-3-iodo-1H-pyridin-2-one.
What is the SMILES notation for 5-fluoro-3-iodo-1H-pyridin-2-one?
The canonical SMILES for 5-fluoro-3-iodo-1H-pyridin-2-one is O=c1[nH]cc(F)cc1I.
What is the InChIKey of 5-fluoro-3-iodo-1H-pyridin-2-one?
The InChIKey is KCBSXUQSZXQHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3FINO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9).
What are the key properties of 5-fluoro-3-iodo-1H-pyridin-2-one?
5-fluoro-3-iodo-1H-pyridin-2-one has a molecular weight of 238.99 g/mol, XLogP of 1.12, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-iodo-1H-pyridin-2-one is sourced from PubChem (CID 46737827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).