6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide

C20H19N5O — CID 78887694

IUPAC6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide
SMILESCc1cc(C(=O)Nc2ccc3ncccc3c2)c2cnn(C(C)C)c2n1
InChIInChI=1S/C20H19N5O/c1-12(2)25-19-17(11-22-25)16(9-13(3)23-19)20(26)24-15-6-7-18-14(10-15)5-4-8-21-18/h4-12H,1-3H3,(H,24,26)
InChIKeyMYYOQTWQNYUMFY-UHFFFAOYSA-N
MW345.41 g/mol
LogP4.12
Rot. Bonds3

About 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide

6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide (PubChem CID 78887694) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide
PubChem CID78887694
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide
SMILESCc1cc(C(=O)Nc2ccc3ncccc3c2)c2cnn(C(C)C)c2n1
InChIInChI=1S/C20H19N5O/c1-12(2)25-19-17(11-22-25)16(9-13(3)23-19)20(26)24-15-6-7-18-14(10-15)5-4-8-21-18/h4-12H,1-3H3,(H,24,26)
InChIKeyMYYOQTWQNYUMFY-UHFFFAOYSA-N
XLogP4.12
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-1-propan-2-yl-N-quinolin-6-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

N-(4-acetamidophenyl)-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 42152657
N-[4-hydroxy-3-(trifluoromethyl)phenyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 71855273
6-methyl-N-(4-methyl-2-pyridinyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 42023810
6-methyl-1-propan-2-yl-N-[3-(propylcarbamoyl)phenyl]pyrazolo[3,4-b]pyridine-4-carboxamide
CID 78875855
6-methyl-1-propan-2-yl-N-[3-(thiophene-2-carbonylamino)phenyl]pyrazolo[3,4-b]pyridine-4-carboxamide
CID 31516879
N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 46671652
1-propan-2-yl-N-quinolin-3-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 18267760
3-[(1-butan-2-yl-6-methylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoic acid
CID 120522396
N-(4-bromo-2-methylphenyl)-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 17489482
6-(5-methylthiophen-2-yl)-1-propan-2-yl-N-[3-(pyridine-4-carbonylamino)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 55610678
N-(2,3-dihydro-1H-inden-2-yl)-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 45490949
2-methyl-N-quinolin-6-yl-5-sulfanylbenzamide
CID 107028520

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide (CID 78887694) is 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide is Cc1cc(C(=O)Nc2ccc3ncccc3c2)c2cnn(C(C)C)c2n1.
What is the InChIKey of 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
The InChIKey is MYYOQTWQNYUMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-12(2)25-19-17(11-22-25)16(9-13(3)23-19)20(26)24-15-6-7-18-14(10-15)5-4-8-21-18/h4-12H,1-3H3,(H,24,26).
What are the key properties of 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide?
6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide has a molecular weight of 345.41 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-propan-2-yl-N-quinolin-6-ylpyrazolo[3,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 78887694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).