6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

C20H31N5O — CID 78858933

IUPAC6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCN(CC(C)C)CC2)c2cnn(C(C)C)c2n1
InChIInChI=1S/C20H31N5O/c1-13(2)12-24-8-6-16(7-9-24)23-20(26)17-10-15(5)22-19-18(17)11-21-25(19)14(3)4/h10-11,13-14,16H,6-9,12H2,1-5H3,(H,23,26)
InChIKeyFJVUNWRGQAWFCI-UHFFFAOYSA-N
MW357.50 g/mol
LogP3.17
Rot. Bonds5

About 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide (PubChem CID 78858933) has the molecular formula C20H31N5O and a molecular weight of 357.50 g/mol. Its IUPAC name is 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
PubChem CID78858933
Molecular FormulaC20H31N5O
Molecular Weight357.50 g/mol
Exact Mass357.25
IUPAC Name6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCN(CC(C)C)CC2)c2cnn(C(C)C)c2n1
InChIInChI=1S/C20H31N5O/c1-13(2)12-24-8-6-16(7-9-24)23-20(26)17-10-15(5)22-19-18(17)11-21-25(19)14(3)4/h10-11,13-14,16H,6-9,12H2,1-5H3,(H,23,26)
InChIKeyFJVUNWRGQAWFCI-UHFFFAOYSA-N
XLogP3.17
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.50
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide 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

6-methyl-1-propan-2-yl-N-pyrrolidin-3-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 119449551
6-methyl-1-propan-2-yl-N-pyrrolidin-3-ylpyrazolo[3,4-b]pyridine-4-carboxamide;dihydrochloride
CID 119449550
N-(2,3-dihydro-1H-inden-2-yl)-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 45490949
6-methyl-N-(2-methylpiperidin-4-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 120600467
N-[(1R,2R)-2-hydroxycyclohexyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 97003571
2-[(6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]cyclooctane-1-carboxylic acid
CID 120533016
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46551293
6-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 56714235
N-(1-methylsulfonylpiperidin-4-yl)-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 39999731
6-methyl-1-propan-2-yl-N-prop-2-ynylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 43044165
3-cyclopropyl-2-[(6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]propanoic acid
CID 120535917
N-[2-(ethylamino)ethyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide;dihydrochloride
CID 119504676

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide (CID 78858933) is 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide is Cc1cc(C(=O)NC2CCN(CC(C)C)CC2)c2cnn(C(C)C)c2n1.
What is the InChIKey of 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
The InChIKey is FJVUNWRGQAWFCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O/c1-13(2)12-24-8-6-16(7-9-24)23-20(26)17-10-15(5)22-19-18(17)11-21-25(19)14(3)4/h10-11,13-14,16H,6-9,12H2,1-5H3,(H,23,26).
What are the key properties of 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide has a molecular weight of 357.50 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 78858933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).