5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid

C8H4BrFN2O2 — CID 172640831

IUPAC5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1cnn2ccc(Br)c(F)c12
InChIInChI=1S/C8H4BrFN2O2/c9-5-1-2-12-7(6(5)10)4(3-11-12)8(13)14/h1-3H,(H,13,14)
InChIKeyTUUHWAWPCYWZOI-UHFFFAOYSA-N
MW259.03 g/mol
LogP1.93
Rot. Bonds1

About 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid

5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid (PubChem CID 172640831) has the molecular formula C8H4BrFN2O2 and a molecular weight of 259.03 g/mol. Its IUPAC name is 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid
PubChem CID172640831
Molecular FormulaC8H4BrFN2O2
Molecular Weight259.03 g/mol
Exact Mass257.94
IUPAC Name5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1cnn2ccc(Br)c(F)c12
InChIInChI=1S/C8H4BrFN2O2/c9-5-1-2-12-7(6(5)10)4(3-11-12)8(13)14/h1-3H,(H,13,14)
InChIKeyTUUHWAWPCYWZOI-UHFFFAOYSA-N
XLogP1.93
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.03
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-4-methylpyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 175276829
5-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 83680695
3-fluoropyrazolo[1,5-a]pyridine-4-carboxylic acid
CID 146457225
4-(hydroxymethyl)pyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 82212449
7-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid;ethane
CID 153371953
4-(chloromethyl)pyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 71699701
4-oxo-5H-pyrazolo[1,5-a]pyrazine-3-carboxylic acid
CID 150678861
1-[(3-bromo-2,6-difluorophenyl)methyl]-5-methylpyrazole-4-carboxylic acid
CID 106264462
5-formylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 175176217
7-bromo-8-fluoroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 178093198
5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 121208399
5-[2-(2,3-difluoro-6-hydroxyphenyl)ethylamino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 134210798

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid?
The IUPAC name of 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid (CID 172640831) is 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid?
The canonical SMILES for 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid is O=C(O)c1cnn2ccc(Br)c(F)c12.
What is the InChIKey of 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid?
The InChIKey is TUUHWAWPCYWZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4BrFN2O2/c9-5-1-2-12-7(6(5)10)4(3-11-12)8(13)14/h1-3H,(H,13,14).
What are the key properties of 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid?
5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid has a molecular weight of 259.03 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 172640831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).