8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid

C14H8F2N2O2 — CID 58515993

IUPAC8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc(F)c2cncn2c1-c1cccc(F)c1
InChIInChI=1S/C14H8F2N2O2/c15-9-3-1-2-8(4-9)13-10(14(19)20)5-11(16)12-6-17-7-18(12)13/h1-7H,(H,19,20)
InChIKeyNBAZAGUSSJNEHB-UHFFFAOYSA-N
MW274.23 g/mol
LogP2.98
Rot. Bonds2

About 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid

8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid (PubChem CID 58515993) has the molecular formula C14H8F2N2O2 and a molecular weight of 274.23 g/mol. Its IUPAC name is 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
PubChem CID58515993
Molecular FormulaC14H8F2N2O2
Molecular Weight274.23 g/mol
Exact Mass274.06
IUPAC Name8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc(F)c2cncn2c1-c1cccc(F)c1
InChIInChI=1S/C14H8F2N2O2/c15-9-3-1-2-8(4-9)13-10(14(19)20)5-11(16)12-6-17-7-18(12)13/h1-7H,(H,19,20)
InChIKeyNBAZAGUSSJNEHB-UHFFFAOYSA-N
XLogP2.98
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.23
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The IUPAC name of 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid (CID 58515993) is 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The canonical SMILES for 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid is O=C(O)c1cc(F)c2cncn2c1-c1cccc(F)c1.
What is the InChIKey of 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The InChIKey is NBAZAGUSSJNEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F2N2O2/c15-9-3-1-2-8(4-9)13-10(14(19)20)5-11(16)12-6-17-7-18(12)13/h1-7H,(H,19,20).
What are the key properties of 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid has a molecular weight of 274.23 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-5-(3-fluorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 58515993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).