1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid

C19H12FN3O2 — CID 25247485

IUPAC1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccccc2)nc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C19H12FN3O2/c20-13-6-8-14(9-7-13)23-18-16(11-21-23)15(19(24)25)10-17(22-18)12-4-2-1-3-5-12/h1-11H,(H,24,25)
InChIKeyHMXZKXBILOZHMK-UHFFFAOYSA-N
MW333.32 g/mol
LogP3.92
Rot. Bonds3

About 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid

1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid (PubChem CID 25247485) has the molecular formula C19H12FN3O2 and a molecular weight of 333.32 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid
PubChem CID25247485
Molecular FormulaC19H12FN3O2
Molecular Weight333.32 g/mol
Exact Mass333.09
IUPAC Name1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccccc2)nc2c1cnn2-c1ccc(F)cc1
InChIInChI=1S/C19H12FN3O2/c20-13-6-8-14(9-7-13)23-18-16(11-21-23)15(19(24)25)10-17(22-18)12-4-2-1-3-5-12/h1-11H,(H,24,25)
InChIKeyHMXZKXBILOZHMK-UHFFFAOYSA-N
XLogP3.92
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.32
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid (CID 25247485) is 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid is O=C(O)c1cc(-c2ccccc2)nc2c1cnn2-c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The InChIKey is HMXZKXBILOZHMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN3O2/c20-13-6-8-14(9-7-13)23-18-16(11-21-23)15(19(24)25)10-17(22-18)12-4-2-1-3-5-12/h1-11H,(H,24,25).
What are the key properties of 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid has a molecular weight of 333.32 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 25247485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).