3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one

C18H12FN3O2 — CID 155115137

IUPAC3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one
SMILESO=c1[nH]cccc1-c1nc(-c2cccc(F)c2O)n2ccccc12
InChIInChI=1S/C18H12FN3O2/c19-13-7-3-5-12(16(13)23)17-21-15(11-6-4-9-20-18(11)24)14-8-1-2-10-22(14)17/h1-10,23H,(H,20,24)
InChIKeyFFXNYLFKEZQOSB-UHFFFAOYSA-N
MW321.31 g/mol
LogP3.20
Rot. Bonds2

About 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one

3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one (PubChem CID 155115137) has the molecular formula C18H12FN3O2 and a molecular weight of 321.31 g/mol. Its IUPAC name is 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one
PubChem CID155115137
Molecular FormulaC18H12FN3O2
Molecular Weight321.31 g/mol
Exact Mass321.09
IUPAC Name3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one
SMILESO=c1[nH]cccc1-c1nc(-c2cccc(F)c2O)n2ccccc12
InChIInChI=1S/C18H12FN3O2/c19-13-7-3-5-12(16(13)23)17-21-15(11-6-4-9-20-18(11)24)14-8-1-2-10-22(14)17/h1-10,23H,(H,20,24)
InChIKeyFFXNYLFKEZQOSB-UHFFFAOYSA-N
XLogP3.20
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.31
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one?
The IUPAC name of 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one (CID 155115137) is 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one.
What is the SMILES notation for 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one?
The canonical SMILES for 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one is O=c1[nH]cccc1-c1nc(-c2cccc(F)c2O)n2ccccc12.
What is the InChIKey of 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one?
The InChIKey is FFXNYLFKEZQOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN3O2/c19-13-7-3-5-12(16(13)23)17-21-15(11-6-4-9-20-18(11)24)14-8-1-2-10-22(14)17/h1-10,23H,(H,20,24).
What are the key properties of 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one?
3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one has a molecular weight of 321.31 g/mol, XLogP of 3.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(3-fluoro-2-hydroxyphenyl)imidazo[1,5-a]pyridin-1-yl]-1H-pyridin-2-one is sourced from PubChem (CID 155115137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).