5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine

C25H21N3 — CID 140743664

IUPAC5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine
SMILESCc1ccccc1-c1ccc2c(n1)N(c1ccccc1)CN2c1ccccc1
InChIInChI=1S/C25H21N3/c1-19-10-8-9-15-22(19)23-16-17-24-25(26-23)28(21-13-6-3-7-14-21)18-27(24)20-11-4-2-5-12-20/h2-17H,18H2,1H3
InChIKeyOEQBELMSTLTXKA-UHFFFAOYSA-N
MW363.46 g/mol
LogP6.30
Rot. Bonds3

About 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine

5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine (PubChem CID 140743664) has the molecular formula C25H21N3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine
PubChem CID140743664
Molecular FormulaC25H21N3
Molecular Weight363.46 g/mol
Exact Mass363.17
IUPAC Name5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine
SMILESCc1ccccc1-c1ccc2c(n1)N(c1ccccc1)CN2c1ccccc1
InChIInChI=1S/C25H21N3/c1-19-10-8-9-15-22(19)23-16-17-24-25(26-23)28(21-13-6-3-7-14-21)18-27(24)20-11-4-2-5-12-20/h2-17H,18H2,1H3
InChIKeyOEQBELMSTLTXKA-UHFFFAOYSA-N
XLogP6.30
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine?
The IUPAC name of 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine (CID 140743664) is 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine is Cc1ccccc1-c1ccc2c(n1)N(c1ccccc1)CN2c1ccccc1.
What is the InChIKey of 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine?
The InChIKey is OEQBELMSTLTXKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3/c1-19-10-8-9-15-22(19)23-16-17-24-25(26-23)28(21-13-6-3-7-14-21)18-27(24)20-11-4-2-5-12-20/h2-17H,18H2,1H3.
What are the key properties of 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine?
5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine has a molecular weight of 363.46 g/mol, XLogP of 6.30, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylphenyl)-1,3-diphenyl-2H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 140743664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).