1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid

C7H9N3O2 — CID 20784737

IUPAC1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid
SMILESO=C(O)N1CCCc2[nH]ncc21
InChIInChI=1S/C7H9N3O2/c11-7(12)10-3-1-2-5-6(10)4-8-9-5/h4H,1-3H2,(H,8,9)(H,11,12)
InChIKeyHFOHVPXKCCUYCY-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.84
Rot. Bonds

About 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid

1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid (PubChem CID 20784737) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid
PubChem CID20784737
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid
SMILESO=C(O)N1CCCc2[nH]ncc21
InChIInChI=1S/C7H9N3O2/c11-7(12)10-3-1-2-5-6(10)4-8-9-5/h4H,1-3H2,(H,8,9)(H,11,12)
InChIKeyHFOHVPXKCCUYCY-UHFFFAOYSA-N
XLogP0.84
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid?
The IUPAC name of 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid (CID 20784737) is 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid?
The canonical SMILES for 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid is O=C(O)N1CCCc2[nH]ncc21.
What is the InChIKey of 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid?
The InChIKey is HFOHVPXKCCUYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c11-7(12)10-3-1-2-5-6(10)4-8-9-5/h4H,1-3H2,(H,8,9)(H,11,12).
What are the key properties of 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid?
1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid has a molecular weight of 167.17 g/mol, XLogP of 0.84, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,6,7-tetrahydropyrazolo[4,5-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 20784737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).