1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid

C8H9N3O3 — CID 69375030

IUPAC1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
SMILESCn1ncc2c1CN(C(=O)O)CC2=O
InChIInChI=1S/C8H9N3O3/c1-10-6-3-11(8(13)14)4-7(12)5(6)2-9-10/h2H,3-4H2,1H3,(H,13,14)
InChIKeyFVSBRURXWLNYTC-UHFFFAOYSA-N
MW195.18 g/mol
LogP0.10
Rot. Bonds

About 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid

1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid (PubChem CID 69375030) has the molecular formula C8H9N3O3 and a molecular weight of 195.18 g/mol. Its IUPAC name is 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
PubChem CID69375030
Molecular FormulaC8H9N3O3
Molecular Weight195.18 g/mol
Exact Mass195.06
IUPAC Name1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
SMILESCn1ncc2c1CN(C(=O)O)CC2=O
InChIInChI=1S/C8H9N3O3/c1-10-6-3-11(8(13)14)4-7(12)5(6)2-9-10/h2H,3-4H2,1H3,(H,13,14)
InChIKeyFVSBRURXWLNYTC-UHFFFAOYSA-N
XLogP0.10
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl 1-methyl-4-oxo-1H,4H,5H,6H,7H-pyrazolo(3,4-c)pyridine-6-carboxylate
CID 69346852
[2-[5-Methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-2-oxoethyl]carbamic acid
CID 156360377
tert-butyl (6S)-6-methyl-3-[(3S)-4,4,4-trifluoro-3-methylbutanoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate
CID 157585885
1-Ethyl-6-methyl-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
CID 59319507
2-(4-acetyl-5-methyl-1H-pyrazol-1-yl)acetic acid
CID 63276965
Tert-butyl 4-oxo-1-prop-2-enyl-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylate
CID 68931044
4-Oxo-1-prop-2-enyl-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
CID 69150421
1-methyl-6,7-dihydro-5H-pyrazolo[5,4-c]pyridin-4-one
CID 83479540
1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxylic acid
CID 90939861
tert-butyl 4-oxo-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-6-carboxylate
CID 135376254
Tert-butyl 1-(2-hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylate
CID 135376582
1-(2-Hydroxyethyl)-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid
CID 135376691

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
The IUPAC name of 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid (CID 69375030) is 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid.
What is the SMILES notation for 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
The canonical SMILES for 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid is Cn1ncc2c1CN(C(=O)O)CC2=O.
What is the InChIKey of 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
The InChIKey is FVSBRURXWLNYTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O3/c1-10-6-3-11(8(13)14)4-7(12)5(6)2-9-10/h2H,3-4H2,1H3,(H,13,14).
What are the key properties of 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid?
1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid has a molecular weight of 195.18 g/mol, XLogP of 0.10, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-oxo-5,7-dihydropyrazolo[5,4-c]pyridine-6-carboxylic acid is sourced from PubChem (CID 69375030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).