6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C24H29N5O2 — CID 9466107

IUPAC6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)c1
InChIInChI=1S/C24H29N5O2/c1-5-28(6-2)24(31)17-8-7-9-18(12-17)26-23(30)19-13-21(16-10-11-16)27-22-20(19)14-25-29(22)15(3)4/h7-9,12-16H,5-6,10-11H2,1-4H3,(H,26,30)
InChIKeyKRDBYPYTIGIHOB-UHFFFAOYSA-N
MW419.53 g/mol
LogP4.62
Rot. Bonds7

About 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 9466107) has the molecular formula C24H29N5O2 and a molecular weight of 419.53 g/mol. Its IUPAC name is 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID9466107
Molecular FormulaC24H29N5O2
Molecular Weight419.53 g/mol
Exact Mass419.23
IUPAC Name6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)c1
InChIInChI=1S/C24H29N5O2/c1-5-28(6-2)24(31)17-8-7-9-18(12-17)26-23(30)19-13-21(16-10-11-16)27-22-20(19)14-25-29(22)15(3)4/h7-9,12-16H,5-6,10-11H2,1-4H3,(H,26,30)
InChIKeyKRDBYPYTIGIHOB-UHFFFAOYSA-N
XLogP4.62
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.53
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-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

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 9466107) is 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CCN(CC)C(=O)c1cccc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)c1.
What is the InChIKey of 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is KRDBYPYTIGIHOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O2/c1-5-28(6-2)24(31)17-8-7-9-18(12-17)26-23(30)19-13-21(16-10-11-16)27-22-20(19)14-25-29(22)15(3)4/h7-9,12-16H,5-6,10-11H2,1-4H3,(H,26,30).
What are the key properties of 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 419.53 g/mol, XLogP of 4.62, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[3-(diethylcarbamoyl)phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 9466107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).