6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid

C20H15N3O2 — CID 86704827

IUPAC6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Cc2c(-c3ccccc3)nn3ccccc23)n1
InChIInChI=1S/C20H15N3O2/c24-20(25)17-10-6-9-15(21-17)13-16-18-11-4-5-12-23(18)22-19(16)14-7-2-1-3-8-14/h1-12H,13H2,(H,24,25)
InChIKeyZYVJHYVQBJMNQG-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.69
Rot. Bonds4

About 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid

6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid (PubChem CID 86704827) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
PubChem CID86704827
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC Name6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Cc2c(-c3ccccc3)nn3ccccc23)n1
InChIInChI=1S/C20H15N3O2/c24-20(25)17-10-6-9-15(21-17)13-16-18-11-4-5-12-23(18)22-19(16)14-7-2-1-3-8-14/h1-12H,13H2,(H,24,25)
InChIKeyZYVJHYVQBJMNQG-UHFFFAOYSA-N
XLogP3.69
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid?
The IUPAC name of 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid (CID 86704827) is 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid is O=C(O)c1cccc(Cc2c(-c3ccccc3)nn3ccccc23)n1.
What is the InChIKey of 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid?
The InChIKey is ZYVJHYVQBJMNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c24-20(25)17-10-6-9-15(21-17)13-16-18-11-4-5-12-23(18)22-19(16)14-7-2-1-3-8-14/h1-12H,13H2,(H,24,25).
What are the key properties of 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid?
6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid has a molecular weight of 329.36 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 86704827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).