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

C13H9BrClN3 — CID 113403041

IUPAC2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccc2[nH]c(-c3cccc(Br)c3Cl)nc2n1
InChIInChI=1S/C13H9BrClN3/c1-7-5-6-10-13(16-7)18-12(17-10)8-3-2-4-9(14)11(8)15/h2-6H,1H3,(H,16,17,18)
InChIKeyUSXNSAXUBOYCSC-UHFFFAOYSA-N
MW322.59 g/mol
LogP4.35
Rot. Bonds1

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

2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 113403041) has the molecular formula C13H9BrClN3 and a molecular weight of 322.59 g/mol. Its IUPAC name is 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID113403041
Molecular FormulaC13H9BrClN3
Molecular Weight322.59 g/mol
Exact Mass320.97
IUPAC Name2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccc2[nH]c(-c3cccc(Br)c3Cl)nc2n1
InChIInChI=1S/C13H9BrClN3/c1-7-5-6-10-13(16-7)18-12(17-10)8-3-2-4-9(14)11(8)15/h2-6H,1H3,(H,16,17,18)
InChIKeyUSXNSAXUBOYCSC-UHFFFAOYSA-N
XLogP4.35
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.59
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-fluorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 81137815
2-(3,5-dibromophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 107972981
2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821265
N-methyl-2-[2-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine
CID 104547214
8-(3-bromo-2-chlorophenyl)-7H-purin-6-amine
CID 114608330
2-(5-chloro-2-methoxyphenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 81137085
2-(3-bromo-4-fluorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 113340205
2-(4-chloro-3-methylphenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 113360589
2-(3-iodophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 81136738
2-(furan-2-yl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 81136731
4-bromo-2-(2-chloro-3-fluorophenyl)-1H-benzimidazole
CID 114271483
5-fluoro-2-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenol
CID 136789745

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine (CID 113403041) is 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine is Cc1ccc2[nH]c(-c3cccc(Br)c3Cl)nc2n1.
What is the InChIKey of 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is USXNSAXUBOYCSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrClN3/c1-7-5-6-10-13(16-7)18-12(17-10)8-3-2-4-9(14)11(8)15/h2-6H,1H3,(H,16,17,18).
What are the key properties of 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine?
2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 322.59 g/mol, XLogP of 4.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 113403041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).