4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one

C15H11FN4O2 — CID 166340488

IUPAC4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1NC(c2ccc(-c3ccc4nncn4c3)cc2F)CO1
InChIInChI=1S/C15H11FN4O2/c16-12-5-9(1-3-11(12)13-7-22-15(21)18-13)10-2-4-14-19-17-8-20(14)6-10/h1-6,8,13H,7H2,(H,18,21)
InChIKeyMAXGWWRVUFWJEE-UHFFFAOYSA-N
MW298.28 g/mol
LogP2.32
Rot. Bonds2

About 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one

4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one (PubChem CID 166340488) has the molecular formula C15H11FN4O2 and a molecular weight of 298.28 g/mol. Its IUPAC name is 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one
PubChem CID166340488
Molecular FormulaC15H11FN4O2
Molecular Weight298.28 g/mol
Exact Mass298.09
IUPAC Name4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1NC(c2ccc(-c3ccc4nncn4c3)cc2F)CO1
InChIInChI=1S/C15H11FN4O2/c16-12-5-9(1-3-11(12)13-7-22-15(21)18-13)10-2-4-14-19-17-8-20(14)6-10/h1-6,8,13H,7H2,(H,18,21)
InChIKeyMAXGWWRVUFWJEE-UHFFFAOYSA-N
XLogP2.32
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one?
The IUPAC name of 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one (CID 166340488) is 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one is O=C1NC(c2ccc(-c3ccc4nncn4c3)cc2F)CO1.
What is the InChIKey of 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one?
The InChIKey is MAXGWWRVUFWJEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4O2/c16-12-5-9(1-3-11(12)13-7-22-15(21)18-13)10-2-4-14-19-17-8-20(14)6-10/h1-6,8,13H,7H2,(H,18,21).
What are the key properties of 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one?
4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one has a molecular weight of 298.28 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-fluoro-4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)phenyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 166340488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).