8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid

C8H5FN2O2 — CID 105438509

IUPAC8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C(O)c1ncn2cccc(F)c12
InChIInChI=1S/C8H5FN2O2/c9-5-2-1-3-11-4-10-6(7(5)11)8(12)13/h1-4H,(H,12,13)
InChIKeyWNVNKFTUVMPALK-UHFFFAOYSA-N
MW180.14 g/mol
LogP1.17
Rot. Bonds1

About 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid

8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 105438509) has the molecular formula C8H5FN2O2 and a molecular weight of 180.14 g/mol. Its IUPAC name is 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID105438509
Molecular FormulaC8H5FN2O2
Molecular Weight180.14 g/mol
Exact Mass180.03
IUPAC Name8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C(O)c1ncn2cccc(F)c12
InChIInChI=1S/C8H5FN2O2/c9-5-2-1-3-11-4-10-6(7(5)11)8(12)13/h1-4H,(H,12,13)
InChIKeyWNVNKFTUVMPALK-UHFFFAOYSA-N
XLogP1.17
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.14
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid (CID 105438509) is 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid is O=C(O)c1ncn2cccc(F)c12.
What is the InChIKey of 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is WNVNKFTUVMPALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2O2/c9-5-2-1-3-11-4-10-6(7(5)11)8(12)13/h1-4H,(H,12,13).
What are the key properties of 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid?
8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 180.14 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoroimidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 105438509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).