N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C21H19N5O2 — CID 134798704

IUPACN-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1cccc(CNC(=O)c2cc(-c3cccnc3)nc3c2cnn3C)c1
InChIInChI=1S/C21H19N5O2/c1-26-20-18(13-24-26)17(10-19(25-20)15-6-4-8-22-12-15)21(27)23-11-14-5-3-7-16(9-14)28-2/h3-10,12-13H,11H2,1-2H3,(H,23,27)
InChIKeyWNIRMXAPESNEPG-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.97
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 134798704) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID134798704
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC NameN-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1cccc(CNC(=O)c2cc(-c3cccnc3)nc3c2cnn3C)c1
InChIInChI=1S/C21H19N5O2/c1-26-20-18(13-24-26)17(10-19(25-20)15-6-4-8-22-12-15)21(27)23-11-14-5-3-7-16(9-14)28-2/h3-10,12-13H,11H2,1-2H3,(H,23,27)
InChIKeyWNIRMXAPESNEPG-UHFFFAOYSA-N
XLogP2.97
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-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 N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 134798704) is N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide is COc1cccc(CNC(=O)c2cc(-c3cccnc3)nc3c2cnn3C)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is WNIRMXAPESNEPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-26-20-18(13-24-26)17(10-19(25-20)15-6-4-8-22-12-15)21(27)23-11-14-5-3-7-16(9-14)28-2/h3-10,12-13H,11H2,1-2H3,(H,23,27).
What are the key properties of N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-1-methyl-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 134798704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).