2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine

C13H9BrFN3 — CID 79796387

IUPAC2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(-c3cc(Br)ccc3F)[nH]c2c1
InChIInChI=1S/C13H9BrFN3/c1-7-4-11-13(16-6-7)18-12(17-11)9-5-8(14)2-3-10(9)15/h2-6H,1H3,(H,16,17,18)
InChIKeySBJBBACTFCHMIG-UHFFFAOYSA-N
MW306.14 g/mol
LogP3.83
Rot. Bonds1

About 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine

2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 79796387) has the molecular formula C13H9BrFN3 and a molecular weight of 306.14 g/mol. Its IUPAC name is 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID79796387
Molecular FormulaC13H9BrFN3
Molecular Weight306.14 g/mol
Exact Mass305.00
IUPAC Name2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(-c3cc(Br)ccc3F)[nH]c2c1
InChIInChI=1S/C13H9BrFN3/c1-7-4-11-13(16-6-7)18-12(17-11)9-5-8(14)2-3-10(9)15/h2-6H,1H3,(H,16,17,18)
InChIKeySBJBBACTFCHMIG-UHFFFAOYSA-N
XLogP3.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.14
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79015323
2-(2-bromo-6-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 114560120
2-(3-bromo-2-methylphenyl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795555
2-(5-bromo-2-fluorophenyl)-5,6-dimethyl-1H-benzimidazole
CID 55185573
2-fluoro-5-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 79795786
2-[4-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79791283
4-(dimethylamino)-N-[4-fluoro-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]butanamide
CID 90403283
4-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-pyrazol-5-amine
CID 79796443
6-bromo-2-(2-fluoro-3-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 81477184
6-methyl-2-phenyl-1H-imidazo[4,5-b]pyridine
CID 79015212
2-(5-bromo-2-fluorophenyl)-4,6-difluoro-1H-benzimidazole
CID 81463556
1-[3-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-4-fluorophenyl]-3-tert-butylurea
CID 90457251

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine (CID 79796387) is 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine is Cc1cnc2nc(-c3cc(Br)ccc3F)[nH]c2c1.
What is the InChIKey of 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is SBJBBACTFCHMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrFN3/c1-7-4-11-13(16-6-7)18-12(17-11)9-5-8(14)2-3-10(9)15/h2-6H,1H3,(H,16,17,18).
What are the key properties of 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine?
2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 306.14 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-fluorophenyl)-6-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 79796387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).