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

C5H3ClFNO — CID 12031535

IUPAC5-chloro-3-fluoro-1H-pyridin-2-one
SMILESO=c1[nH]cc(Cl)cc1F
InChIInChI=1S/C5H3ClFNO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9)
InChIKeyAKLNMOLGRGQMFY-UHFFFAOYSA-N
MW147.54 g/mol
LogP1.17
Rot. Bonds

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

5-chloro-3-fluoro-1H-pyridin-2-one (PubChem CID 12031535) has the molecular formula C5H3ClFNO and a molecular weight of 147.54 g/mol. Its IUPAC name is 5-chloro-3-fluoro-1H-pyridin-2-one.

Molecular Properties

Compound Name5-chloro-3-fluoro-1H-pyridin-2-one
PubChem CID12031535
Molecular FormulaC5H3ClFNO
Molecular Weight147.54 g/mol
Exact Mass146.99
IUPAC Name5-chloro-3-fluoro-1H-pyridin-2-one
SMILESO=c1[nH]cc(Cl)cc1F
InChIInChI=1S/C5H3ClFNO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9)
InChIKeyAKLNMOLGRGQMFY-UHFFFAOYSA-N
XLogP1.17
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.54
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,5-Dichloro-2-pyridone
CID 79496
5-Chloro-2-pyridone
CID 77889
3-Fluoro-2-hydroxypyridine
CID 2783363
3-Chloro-2-hydroxypyridine
CID 582210
3-Bromo-5-chloropyridin-2-ol
CID 2726791
4-Chloropyridin-2-ol
CID 2757611
5-Fluoro-2-hydroxypyridine
CID 2762864
5-Bromo-3-fluoro-1,2-dihydropyridin-2-one
CID 19387560
5-Chloro-3-iodopyridin-2-ol
CID 19597644
5-Fluoro-3-iodopyridin-2(1H)-one
CID 46737827
2(1H)-Pyridinone, 3,5-difluoro-
CID 12000513
5-Chloro-3-(trifluoromethyl)pyridin-2-ol
CID 18988867

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-fluoro-1H-pyridin-2-one?
The IUPAC name of 5-chloro-3-fluoro-1H-pyridin-2-one (CID 12031535) is 5-chloro-3-fluoro-1H-pyridin-2-one.
What is the SMILES notation for 5-chloro-3-fluoro-1H-pyridin-2-one?
The canonical SMILES for 5-chloro-3-fluoro-1H-pyridin-2-one is O=c1[nH]cc(Cl)cc1F.
What is the InChIKey of 5-chloro-3-fluoro-1H-pyridin-2-one?
The InChIKey is AKLNMOLGRGQMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClFNO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9).
What are the key properties of 5-chloro-3-fluoro-1H-pyridin-2-one?
5-chloro-3-fluoro-1H-pyridin-2-one has a molecular weight of 147.54 g/mol, XLogP of 1.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-fluoro-1H-pyridin-2-one is sourced from PubChem (CID 12031535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).