3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid

C17H12ClFN2O2 — CID 67112297

IUPAC3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1nn2c(-c3cccc(F)c3)cc(C3CC3)cc2c1Cl
InChIInChI=1S/C17H12ClFN2O2/c18-15-14-8-11(9-4-5-9)7-13(10-2-1-3-12(19)6-10)21(14)20-16(15)17(22)23/h1-3,6-9H,4-5H2,(H,22,23)
InChIKeyJQYYDTISRAUICU-UHFFFAOYSA-N
MW330.75 g/mol
LogP4.37
Rot. Bonds3

About 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid

3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid (PubChem CID 67112297) has the molecular formula C17H12ClFN2O2 and a molecular weight of 330.75 g/mol. Its IUPAC name is 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
PubChem CID67112297
Molecular FormulaC17H12ClFN2O2
Molecular Weight330.75 g/mol
Exact Mass330.06
IUPAC Name3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1nn2c(-c3cccc(F)c3)cc(C3CC3)cc2c1Cl
InChIInChI=1S/C17H12ClFN2O2/c18-15-14-8-11(9-4-5-9)7-13(10-2-1-3-12(19)6-10)21(14)20-16(15)17(22)23/h1-3,6-9H,4-5H2,(H,22,23)
InChIKeyJQYYDTISRAUICU-UHFFFAOYSA-N
XLogP4.37
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.75
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
The IUPAC name of 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid (CID 67112297) is 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
The canonical SMILES for 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid is O=C(O)c1nn2c(-c3cccc(F)c3)cc(C3CC3)cc2c1Cl.
What is the InChIKey of 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
The InChIKey is JQYYDTISRAUICU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClFN2O2/c18-15-14-8-11(9-4-5-9)7-13(10-2-1-3-12(19)6-10)21(14)20-16(15)17(22)23/h1-3,6-9H,4-5H2,(H,22,23).
What are the key properties of 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid?
3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid has a molecular weight of 330.75 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 67112297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).