N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide

C21H18N4O — CID 46277196

IUPACN-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide
SMILESCCc1ccc(NC(=O)c2ccc(-n3cnc4cccnc43)cc2)cc1
InChIInChI=1S/C21H18N4O/c1-2-15-5-9-17(10-6-15)24-21(26)16-7-11-18(12-8-16)25-14-23-19-4-3-13-22-20(19)25/h3-14H,2H2,1H3,(H,24,26)
InChIKeyLJTPMDVZMYQCGY-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.24
Rot. Bonds4

About N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide

N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide (PubChem CID 46277196) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide
PubChem CID46277196
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC NameN-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide
SMILESCCc1ccc(NC(=O)c2ccc(-n3cnc4cccnc43)cc2)cc1
InChIInChI=1S/C21H18N4O/c1-2-15-5-9-17(10-6-15)24-21(26)16-7-11-18(12-8-16)25-14-23-19-4-3-13-22-20(19)25/h3-14H,2H2,1H3,(H,24,26)
InChIKeyLJTPMDVZMYQCGY-UHFFFAOYSA-N
XLogP4.24
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-ethylphenyl)methyl]-3-(4-imidazo[4,5-b]pyridin-3-ylphenyl)propanamide
CID 20916234
4-(acetamidomethyl)-N-[4-(benzimidazol-1-yl)phenyl]benzamide
CID 39964592
4-[[4-(benzimidazol-1-yl)benzoyl]amino]-N-propylbenzamide
CID 55948136
2-bromo-1-(4-imidazo[4,5-b]pyridin-3-ylphenyl)ethanone;hydrobromide
CID 162335938
4-imidazo[4,5-b]pyridin-3-yl-N-(2-methylcyclohexyl)benzamide
CID 20916012
N-(4-ethylphenyl)-4-(tetrazol-1-yl)benzamide
CID 7465186
4-ethyl-N-pyridin-4-ylbenzamide
CID 2712552
N-(4-ethylphenyl)benzamide
CID 774063
4-(benzimidazol-1-yl)-N-[4-[2-(4-methylpiperazin-1-yl)ethyl]phenyl]benzamide
CID 86822181
N-(4-ethoxyphenyl)-4-(triazolo[4,5-b]pyridin-3-yl)benzamide
CID 53067502
N-(4-ethylphenyl)-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperazine-1-carboxamide
CID 83274086
4-(1,3-dioxoisoindol-2-yl)-N-(4-ethylphenyl)benzamide
CID 1188829

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide?
The IUPAC name of N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide (CID 46277196) is N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide.
What is the SMILES notation for N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide?
The canonical SMILES for N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide is CCc1ccc(NC(=O)c2ccc(-n3cnc4cccnc43)cc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide?
The InChIKey is LJTPMDVZMYQCGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-2-15-5-9-17(10-6-15)24-21(26)16-7-11-18(12-8-16)25-14-23-19-4-3-13-22-20(19)25/h3-14H,2H2,1H3,(H,24,26).
What are the key properties of N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide?
N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide has a molecular weight of 342.40 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylbenzamide is sourced from PubChem (CID 46277196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).