5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid

C20H14FN3O2 — CID 90095875

IUPAC5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESCc1cc(-c2ncccc2-c2ccn3ncc(C(=O)O)c3c2)ccc1F
InChIInChI=1S/C20H14FN3O2/c1-12-9-14(4-5-17(12)21)19-15(3-2-7-22-19)13-6-8-24-18(10-13)16(11-23-24)20(25)26/h2-11H,1H3,(H,25,26)
InChIKeyDXNGGQJLBREIJS-UHFFFAOYSA-N
MW347.35 g/mol
LogP4.21
Rot. Bonds3

About 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid

5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid (PubChem CID 90095875) has the molecular formula C20H14FN3O2 and a molecular weight of 347.35 g/mol. Its IUPAC name is 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid
PubChem CID90095875
Molecular FormulaC20H14FN3O2
Molecular Weight347.35 g/mol
Exact Mass347.11
IUPAC Name5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESCc1cc(-c2ncccc2-c2ccn3ncc(C(=O)O)c3c2)ccc1F
InChIInChI=1S/C20H14FN3O2/c1-12-9-14(4-5-17(12)21)19-15(3-2-7-22-19)13-6-8-24-18(10-13)16(11-23-24)20(25)26/h2-11H,1H3,(H,25,26)
InChIKeyDXNGGQJLBREIJS-UHFFFAOYSA-N
XLogP4.21
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.35
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid?
The IUPAC name of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid (CID 90095875) is 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid?
The canonical SMILES for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid is Cc1cc(-c2ncccc2-c2ccn3ncc(C(=O)O)c3c2)ccc1F.
What is the InChIKey of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid?
The InChIKey is DXNGGQJLBREIJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O2/c1-12-9-14(4-5-17(12)21)19-15(3-2-7-22-19)13-6-8-24-18(10-13)16(11-23-24)20(25)26/h2-11H,1H3,(H,25,26).
What are the key properties of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid?
5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid has a molecular weight of 347.35 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 90095875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).