2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid

C8H7N3O2 — CID 84655847

IUPAC2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid
SMILESO=C(O)Cc1[nH]nc2cccnc12
InChIInChI=1S/C8H7N3O2/c12-7(13)4-6-8-5(10-11-6)2-1-3-9-8/h1-3H,4H2,(H,10,11)(H,12,13)
InChIKeyZYELGBAWBWJGCC-UHFFFAOYSA-N
MW177.16 g/mol
LogP0.58
Rot. Bonds2

About 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid

2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid (PubChem CID 84655847) has the molecular formula C8H7N3O2 and a molecular weight of 177.16 g/mol. Its IUPAC name is 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid.

Molecular Properties

Compound Name2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid
PubChem CID84655847
Molecular FormulaC8H7N3O2
Molecular Weight177.16 g/mol
Exact Mass177.05
IUPAC Name2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid
SMILESO=C(O)Cc1[nH]nc2cccnc12
InChIInChI=1S/C8H7N3O2/c12-7(13)4-6-8-5(10-11-6)2-1-3-9-8/h1-3H,4H2,(H,10,11)(H,12,13)
InChIKeyZYELGBAWBWJGCC-UHFFFAOYSA-N
XLogP0.58
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2H-pyrazolo[4,3-b]pyridin-3-yl)butanoic acid
CID 84673059
2-(3-ethyl-2H-indazol-4-yl)acetic acid
CID 84672219
ethyl 2-(2H-indazol-3-yl)acetate;2-(2H-indazol-3-yl)acetic acid
CID 158451727
3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine
CID 157274567
2-methyl-1-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)-3H-imidazo[4,5-b]pyridin-1-ium
CID 123575187
2-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetic acid
CID 121213660
bis(2-(2-pyridin-2-yl-3-pyridinyl)acetic acid);zinc
CID 166063488
2-(3-sulfanyl-2-pyridinyl)acetic acid
CID 91518521
2-(3-amino-2-pyridinyl)acetic acid
CID 12716519
3-[(5-chloro-8-fluoronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine
CID 159055346
2-quinolin-7-ylacetic acid
CID 18675903
3-quinolin-5-ylpropanoic acid
CID 81224223

Frequently Asked Questions

What is the IUPAC name of 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid?
The IUPAC name of 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid (CID 84655847) is 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid.
What is the SMILES notation for 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid?
The canonical SMILES for 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid is O=C(O)Cc1[nH]nc2cccnc12.
What is the InChIKey of 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid?
The InChIKey is ZYELGBAWBWJGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2/c12-7(13)4-6-8-5(10-11-6)2-1-3-9-8/h1-3H,4H2,(H,10,11)(H,12,13).
What are the key properties of 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid?
2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid has a molecular weight of 177.16 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-pyrazolo[4,3-b]pyridin-3-yl)acetic acid is sourced from PubChem (CID 84655847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).