2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine

C13H9Br2N3 — CID 107972981

IUPAC2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccc2[nH]c(-c3cc(Br)cc(Br)c3)nc2n1
InChIInChI=1S/C13H9Br2N3/c1-7-2-3-11-13(16-7)18-12(17-11)8-4-9(14)6-10(15)5-8/h2-6H,1H3,(H,16,17,18)
InChIKeyCWQYWESNJHYOJV-UHFFFAOYSA-N
MW367.04 g/mol
LogP4.46
Rot. Bonds1

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

2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 107972981) has the molecular formula C13H9Br2N3 and a molecular weight of 367.04 g/mol. Its IUPAC name is 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID107972981
Molecular FormulaC13H9Br2N3
Molecular Weight367.04 g/mol
Exact Mass364.92
IUPAC Name2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccc2[nH]c(-c3cc(Br)cc(Br)c3)nc2n1
InChIInChI=1S/C13H9Br2N3/c1-7-2-3-11-13(16-7)18-12(17-11)8-4-9(14)6-10(15)5-8/h2-6H,1H3,(H,16,17,18)
InChIKeyCWQYWESNJHYOJV-UHFFFAOYSA-N
XLogP4.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.04
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine (CID 107972981) is 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine is Cc1ccc2[nH]c(-c3cc(Br)cc(Br)c3)nc2n1.
What is the InChIKey of 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is CWQYWESNJHYOJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2N3/c1-7-2-3-11-13(16-7)18-12(17-11)8-4-9(14)6-10(15)5-8/h2-6H,1H3,(H,16,17,18).
What are the key properties of 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 367.04 g/mol, XLogP of 4.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 107972981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).