5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine

C17H19N3O — CID 79816768

IUPAC5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCCOc1ccc2[nH]c(-c3c(C)cc(C)cc3C)nc2n1
InChIInChI=1S/C17H19N3O/c1-5-21-14-7-6-13-16(19-14)20-17(18-13)15-11(3)8-10(2)9-12(15)4/h6-9H,5H2,1-4H3,(H,18,19,20)
InChIKeyGAMFFCADTZHPHR-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.95
Rot. Bonds3

About 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine

5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 79816768) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine
PubChem CID79816768
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCCOc1ccc2[nH]c(-c3c(C)cc(C)cc3C)nc2n1
InChIInChI=1S/C17H19N3O/c1-5-21-14-7-6-13-16(19-14)20-17(18-13)15-11(3)8-10(2)9-12(15)4/h6-9H,5H2,1-4H3,(H,18,19,20)
InChIKeyGAMFFCADTZHPHR-UHFFFAOYSA-N
XLogP3.95
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine (CID 79816768) is 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine is CCOc1ccc2[nH]c(-c3c(C)cc(C)cc3C)nc2n1.
What is the InChIKey of 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is GAMFFCADTZHPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-5-21-14-7-6-13-16(19-14)20-17(18-13)15-11(3)8-10(2)9-12(15)4/h6-9H,5H2,1-4H3,(H,18,19,20).
What are the key properties of 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine?
5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 281.36 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 79816768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).