2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine

C25H19N7O — CID 126553261

IUPAC2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1cccc(-c2ccnc3nc(C4=C=Nc5ccc(-c6cnc(C)n6C)nc54)[nH]c23)c1
InChIInChI=1S/C25H19N7O/c1-14-27-13-21(32(14)2)19-7-8-20-22(29-19)18(12-28-20)24-30-23-17(9-10-26-25(23)31-24)15-5-4-6-16(11-15)33-3/h4-11,13H,1-3H3,(H,26,30,31)
InChIKeyXTFWWOXFEBZPIK-UHFFFAOYSA-N
MW433.48 g/mol
LogP4.48
Rot. Bonds4

About 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine

2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 126553261) has the molecular formula C25H19N7O and a molecular weight of 433.48 g/mol. Its IUPAC name is 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
PubChem CID126553261
Molecular FormulaC25H19N7O
Molecular Weight433.48 g/mol
Exact Mass433.17
IUPAC Name2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1cccc(-c2ccnc3nc(C4=C=Nc5ccc(-c6cnc(C)n6C)nc54)[nH]c23)c1
InChIInChI=1S/C25H19N7O/c1-14-27-13-21(32(14)2)19-7-8-20-22(29-19)18(12-28-20)24-30-23-17(9-10-26-25(23)31-24)15-5-4-6-16(11-15)33-3/h4-11,13H,1-3H3,(H,26,30,31)
InChIKeyXTFWWOXFEBZPIK-UHFFFAOYSA-N
XLogP4.48
TPSA93.87 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.48
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine 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

2-[5-(2,3-dimethylimidazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-(3-fluorophenyl)-1H-imidazo[4,5-b]pyridine
CID 137042283
2-[5-(2,3-dimethylimidazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridine
CID 137042025
ethane;[2-fluoro-4-[2-(5-methoxy-2-pyridinyl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl]methanamine
CID 145061644
2-[5-(2,3-dimethylimidazol-4-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]-7-(5-prop-1-en-2-ylthiophen-2-yl)-1H-imidazo[4,5-b]pyridine
CID 145035738
6-chloro-8-(3-methoxyphenyl)-7H-purine
CID 24903924
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-7-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridine
CID 136937844
3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 136937475
5-(2,3-dimethylimidazol-4-yl)-3-(4-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137489220
1-bromo-2-(3-methoxyphenyl)imidazole
CID 175313145
3-[7-(3-fluoro-5-methoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyridin-2-yl-2H-pyrazolo[3,4-b]pyridine
CID 136946056
2-[5-(5-methoxy-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-(4-methylimidazol-1-yl)-1H-imidazo[4,5-b]pyridine
CID 137042336
3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine
CID 101485058

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine (CID 126553261) is 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine is COc1cccc(-c2ccnc3nc(C4=C=Nc5ccc(-c6cnc(C)n6C)nc54)[nH]c23)c1.
What is the InChIKey of 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is XTFWWOXFEBZPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N7O/c1-14-27-13-21(32(14)2)19-7-8-20-22(29-19)18(12-28-20)24-30-23-17(9-10-26-25(23)31-24)15-5-4-6-16(11-15)33-3/h4-11,13H,1-3H3,(H,26,30,31).
What are the key properties of 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 433.48 g/mol, XLogP of 4.48, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2,3-dimethylimidazol-4-yl)pyrrolo[3,2-b]pyridin-3-yl]-7-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 126553261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).