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

C10H8N2O4 — CID 123725403

IUPAC5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESCOC(=O)c1ccn2ncc(C(=O)O)c2c1
InChIInChI=1S/C10H8N2O4/c1-16-10(15)6-2-3-12-8(4-6)7(5-11-12)9(13)14/h2-5H,1H3,(H,13,14)
InChIKeyWEOCGDKAUXFPDP-UHFFFAOYSA-N
MW220.18 g/mol
LogP0.82
Rot. Bonds2

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

5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid (PubChem CID 123725403) has the molecular formula C10H8N2O4 and a molecular weight of 220.18 g/mol. Its IUPAC name is 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid
PubChem CID123725403
Molecular FormulaC10H8N2O4
Molecular Weight220.18 g/mol
Exact Mass220.05
IUPAC Name5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESCOC(=O)c1ccn2ncc(C(=O)O)c2c1
InChIInChI=1S/C10H8N2O4/c1-16-10(15)6-2-3-12-8(4-6)7(5-11-12)9(13)14/h2-5H,1H3,(H,13,14)
InChIKeyWEOCGDKAUXFPDP-UHFFFAOYSA-N
XLogP0.82
TPSA80.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.18
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid?
The IUPAC name of 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid (CID 123725403) is 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid?
The canonical SMILES for 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid is COC(=O)c1ccn2ncc(C(=O)O)c2c1.
What is the InChIKey of 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid?
The InChIKey is WEOCGDKAUXFPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O4/c1-16-10(15)6-2-3-12-8(4-6)7(5-11-12)9(13)14/h2-5H,1H3,(H,13,14).
What are the key properties of 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid?
5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid has a molecular weight of 220.18 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxycarbonylpyrazolo[1,5-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 123725403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).