3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid

C9H6N2O3 — CID 59476245

IUPAC3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid
SMILESO=Cc1cnn2ccc(C(=O)O)cc12
InChIInChI=1S/C9H6N2O3/c12-5-7-4-10-11-2-1-6(9(13)14)3-8(7)11/h1-5H,(H,13,14)
InChIKeyHLAIFYPVBLQHGX-UHFFFAOYSA-N
MW190.16 g/mol
LogP0.85
Rot. Bonds2

About 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid

3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid (PubChem CID 59476245) has the molecular formula C9H6N2O3 and a molecular weight of 190.16 g/mol. Its IUPAC name is 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid
PubChem CID59476245
Molecular FormulaC9H6N2O3
Molecular Weight190.16 g/mol
Exact Mass190.04
IUPAC Name3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid
SMILESO=Cc1cnn2ccc(C(=O)O)cc12
InChIInChI=1S/C9H6N2O3/c12-5-7-4-10-11-2-1-6(9(13)14)3-8(7)11/h1-5H,(H,13,14)
InChIKeyHLAIFYPVBLQHGX-UHFFFAOYSA-N
XLogP0.85
TPSA71.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.16
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-formylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 25171438
3-formylpyrazolo[1,5-a]pyridine-5-carboxamide;5-(2-hydroxyethyl)pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 160861137
N-(3-formylpyrazolo[1,5-a]pyridin-5-yl)acetamide
CID 89029718
3-[4-(piperidin-1-ylmethyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxylic acid
CID 166287912
4-carboxy-2-formylphenolate
CID 54710110
1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84742895
3-bromopyrazolo[1,5-a]pyridine-5-carboxamide
CID 171597831
2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid
CID 103119978
5-[4-[4-(2-chlorophenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 25071386
2,5-dimethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;5-methylpyrazolo[1,5-a]pyridine-3-carbaldehyde;5-(trifluoromethyl)pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 87551362
1-formyl-3-propan-2-ylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84740930
3-(aminomethyl)-1-formylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84740260

Frequently Asked Questions

What is the IUPAC name of 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid?
The IUPAC name of 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid (CID 59476245) is 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid?
The canonical SMILES for 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid is O=Cc1cnn2ccc(C(=O)O)cc12.
What is the InChIKey of 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid?
The InChIKey is HLAIFYPVBLQHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N2O3/c12-5-7-4-10-11-2-1-6(9(13)14)3-8(7)11/h1-5H,(H,13,14).
What are the key properties of 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid?
3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid has a molecular weight of 190.16 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 59476245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).