2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid

C8H7N3O3 — CID 135992873

IUPAC2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid
SMILESO=C(O)Cn1ncc2c(=O)[nH]ccc21
InChIInChI=1S/C8H7N3O3/c12-7(13)4-11-6-1-2-9-8(14)5(6)3-10-11/h1-3H,4H2,(H,9,14)(H,12,13)
InChIKeyJNSQRFTWOABPHJ-UHFFFAOYSA-N
MW193.16 g/mol
LogP-0.19
Rot. Bonds2

About 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid

2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid (PubChem CID 135992873) has the molecular formula C8H7N3O3 and a molecular weight of 193.16 g/mol. Its IUPAC name is 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid
PubChem CID135992873
Molecular FormulaC8H7N3O3
Molecular Weight193.16 g/mol
Exact Mass193.05
IUPAC Name2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid
SMILESO=C(O)Cn1ncc2c(=O)[nH]ccc21
InChIInChI=1S/C8H7N3O3/c12-7(13)4-11-6-1-2-9-8(14)5(6)3-10-11/h1-3H,4H2,(H,9,14)(H,12,13)
InChIKeyJNSQRFTWOABPHJ-UHFFFAOYSA-N
XLogP-0.19
TPSA87.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.16
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)methyl]phenyl]phosphonic acid
CID 155195374
2-(4-oxocinnolin-1-yl)acetic acid
CID 7131158
2-(5-methyl-4-oxopyrazolo[4,5-c]pyridin-1-yl)acetic acid
CID 59512229
1-propan-2-yl-5H-pyrazolo[4,5-c]pyridin-4-one
CID 137277698
CID 167551519
CID 167551519
2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetic acid
CID 22334744
2-(4-oxocinnolin-1-yl)acetate
CID 7131157
2-(5,8-dimethyl-4-oxopyrazolo[4,5-c]quinolin-1-yl)acetic acid
CID 59004239
2-(2,3-dimethyl-7-oxothieno[2,3-d]pyridazin-6-yl)acetic acid
CID 121349770
1-(2-hydroxyethoxymethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 135453822
2-(5-amino-3-oxo-1,2,4-triazin-2-yl)acetic acid
CID 54517264
2-(7-methyl-1-oxophthalazin-2-yl)acetic acid
CID 125455649

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid?
The IUPAC name of 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid (CID 135992873) is 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid.
What is the SMILES notation for 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid?
The canonical SMILES for 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid is O=C(O)Cn1ncc2c(=O)[nH]ccc21.
What is the InChIKey of 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid?
The InChIKey is JNSQRFTWOABPHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O3/c12-7(13)4-11-6-1-2-9-8(14)5(6)3-10-11/h1-3H,4H2,(H,9,14)(H,12,13).
What are the key properties of 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid?
2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid has a molecular weight of 193.16 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxo-5H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid is sourced from PubChem (CID 135992873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).