3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid

C13H16N4O2 — CID 141435483

IUPAC3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid
SMILESCc1c2cc(C(=O)O)cnc2nn1C1CCNCC1
InChIInChI=1S/C13H16N4O2/c1-8-11-6-9(13(18)19)7-15-12(11)16-17(8)10-2-4-14-5-3-10/h6-7,10,14H,2-5H2,1H3,(H,18,19)
InChIKeyZVOFRNPPJRWRHJ-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.36
Rot. Bonds2

About 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid

3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid (PubChem CID 141435483) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid
PubChem CID141435483
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid
SMILESCc1c2cc(C(=O)O)cnc2nn1C1CCNCC1
InChIInChI=1S/C13H16N4O2/c1-8-11-6-9(13(18)19)7-15-12(11)16-17(8)10-2-4-14-5-3-10/h6-7,10,14H,2-5H2,1H3,(H,18,19)
InChIKeyZVOFRNPPJRWRHJ-UHFFFAOYSA-N
XLogP1.36
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclopropyl-2-methylpyrazolo[3,4-b]pyridine-5-carboxylic acid
CID 83910073
1-methyl-2,3-dioxo-4-piperidin-4-ylpyrido[2,3-b]pyrazine-7-carboxylic acid
CID 170238575
3-methyl-N-(4-methylphenyl)-1-piperidin-4-ylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 135253218
2-methyl-3-(2-methylpropyl)pyrazolo[3,4-b]pyridine-5-carboxylic acid
CID 83911752
3-cyclopropyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CID 83881393
4-(3,4,5-trimethylpyrazol-1-yl)piperidine
CID 61346158
[4-(5-methyl-1-piperidin-4-yltriazole-4-carbonyl)piperazin-1-yl]-phenylmethanone
CID 119683408
3-methyl-N-piperidin-3-yl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 119429140
3-methyl-N-piperidin-3-yl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;dihydrochloride
CID 119429139
6-(2,3-dimethylpiperidin-1-yl)-5-methylpyridine-3-carboxylic acid
CID 80631782
6,7,8,9-tetrahydro-5H-pyrido[2,3-d]azepine-3-carboxylic acid
CID 105445983
ethane;4-(4-ethyl-5-methylpyrazol-1-yl)piperidine
CID 171660480

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
The IUPAC name of 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid (CID 141435483) is 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid.
What is the SMILES notation for 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
The canonical SMILES for 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid is Cc1c2cc(C(=O)O)cnc2nn1C1CCNCC1.
What is the InChIKey of 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
The InChIKey is ZVOFRNPPJRWRHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-8-11-6-9(13(18)19)7-15-12(11)16-17(8)10-2-4-14-5-3-10/h6-7,10,14H,2-5H2,1H3,(H,18,19).
What are the key properties of 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid?
3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid has a molecular weight of 260.30 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-piperidin-4-ylpyrazolo[3,4-b]pyridine-5-carboxylic acid is sourced from PubChem (CID 141435483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).