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

C13H10BrN3O — CID 15892244

IUPAC6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc(-c2nc3ncc(Br)cc3[nH]2)cc1
InChIInChI=1S/C13H10BrN3O/c1-18-10-4-2-8(3-5-10)12-16-11-6-9(14)7-15-13(11)17-12/h2-7H,1H3,(H,15,16,17)
InChIKeyKXXNSRRQEABRTD-UHFFFAOYSA-N
MW304.15 g/mol
LogP3.40
Rot. Bonds2

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

6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 15892244) has the molecular formula C13H10BrN3O and a molecular weight of 304.15 g/mol. Its IUPAC name is 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
PubChem CID15892244
Molecular FormulaC13H10BrN3O
Molecular Weight304.15 g/mol
Exact Mass303.00
IUPAC Name6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc(-c2nc3ncc(Br)cc3[nH]2)cc1
InChIInChI=1S/C13H10BrN3O/c1-18-10-4-2-8(3-5-10)12-16-11-6-9(14)7-15-13(11)17-12/h2-7H,1H3,(H,15,16,17)
InChIKeyKXXNSRRQEABRTD-UHFFFAOYSA-N
XLogP3.40
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.15
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Byk-191023
CID 10308091
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CID 5328263
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
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5-(4-Methoxyphenyl)-2-phenyl-1H-imidazole
CID 12024852
6-(4-methoxyphenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538782
6-(3,4-dimethoxyphenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538783
6-(4-methoxyphenyl)-7-propyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538784
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 36
CID 6538786
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 34
CID 6538787

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine (CID 15892244) is 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine is COc1ccc(-c2nc3ncc(Br)cc3[nH]2)cc1.
What is the InChIKey of 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is KXXNSRRQEABRTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN3O/c1-18-10-4-2-8(3-5-10)12-16-11-6-9(14)7-15-13(11)17-12/h2-7H,1H3,(H,15,16,17).
What are the key properties of 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 304.15 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 15892244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).