1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid

C16H16N4O2 — CID 16790291

IUPAC1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCCC(C)n1ncc2c(C(=O)O)cc(-c3ccncc3)nc21
InChIInChI=1S/C16H16N4O2/c1-3-10(2)20-15-13(9-18-20)12(16(21)22)8-14(19-15)11-4-6-17-7-5-11/h4-10H,3H2,1-2H3,(H,21,22)
InChIKeyTYZUQQJVMYGINY-UHFFFAOYSA-N
MW296.33 g/mol
LogP3.16
Rot. Bonds4

About 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid

1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid (PubChem CID 16790291) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
PubChem CID16790291
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
SMILESCCC(C)n1ncc2c(C(=O)O)cc(-c3ccncc3)nc21
InChIInChI=1S/C16H16N4O2/c1-3-10(2)20-15-13(9-18-20)12(16(21)22)8-14(19-15)11-4-6-17-7-5-11/h4-10H,3H2,1-2H3,(H,21,22)
InChIKeyTYZUQQJVMYGINY-UHFFFAOYSA-N
XLogP3.16
TPSA80.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2R)-butan-2-yl]-6-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 28842366
N-butan-2-yl-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46689566
1-(6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)ethanone
CID 59373559
N-butan-2-yl-N-methyl-6-(4-methylphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55589524
[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] 6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 8980450
(4-ethylpiperazin-1-yl)-(6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)methanone
CID 78791094
1-butan-2-yl-6-[2-(1,3-oxazol-4-yl)ethenyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 136590679
3-[(1-butan-2-yl-6-methylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoic acid
CID 120522396
3-[(1-butan-2-yl-6-methylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4-methylbenzoic acid
CID 120522318
2-[ethyl-[6-(4-methylphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbonyl]amino]acetic acid
CID 120519811
N-(3-aminobutyl)-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 119497417
propan-2-yl 6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 46538389

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid (CID 16790291) is 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid is CCC(C)n1ncc2c(C(=O)O)cc(-c3ccncc3)nc21.
What is the InChIKey of 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
The InChIKey is TYZUQQJVMYGINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-3-10(2)20-15-13(9-18-20)12(16(21)22)8-14(19-15)11-4-6-17-7-5-11/h4-10H,3H2,1-2H3,(H,21,22).
What are the key properties of 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid?
1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid has a molecular weight of 296.33 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-6-pyridin-4-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 16790291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).