7-bromo-1H-imidazo[4,5-b]pyridine

C6H4BrN3 — CID 53423966

IUPAC7-bromo-1H-imidazo[4,5-b]pyridine
SMILESBrc1ccnc2nc[nH]c12
InChIInChI=1S/C6H4BrN3/c7-4-1-2-8-6-5(4)9-3-10-6/h1-3H,(H,8,9,10)
InChIKeyDEFSPWZHYXXHLB-UHFFFAOYSA-N
MW198.02 g/mol
LogP1.72
Rot. Bonds

About 7-bromo-1H-imidazo[4,5-b]pyridine

7-bromo-1H-imidazo[4,5-b]pyridine (PubChem CID 53423966) has the molecular formula C6H4BrN3 and a molecular weight of 198.02 g/mol. Its IUPAC name is 7-bromo-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-bromo-1H-imidazo[4,5-b]pyridine
PubChem CID53423966
Molecular FormulaC6H4BrN3
Molecular Weight198.02 g/mol
Exact Mass196.96
IUPAC Name7-bromo-1H-imidazo[4,5-b]pyridine
SMILESBrc1ccnc2nc[nH]c12
InChIInChI=1S/C6H4BrN3/c7-4-1-2-8-6-5(4)9-3-10-6/h1-3H,(H,8,9,10)
InChIKeyDEFSPWZHYXXHLB-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.02
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2'-Pyridyl)benzimidazole
CID 70821
Ageladine A
CID 10089677
5H-Pyrrolo(3,2-d)pyrimidin-4-amine
CID 5287565
Imidazo(4,5-b)pyridine
CID 67504
6-bromo-1H-pyrrolo[3,2-b]pyridin-5-amine
CID 92130857
6-Bromo-4-azabenzimidazole
CID 911578
2-(1H-imidazol-2-yl)pyridine
CID 589313
3H-Imidazo(4,5-b)pyridine, 6-bromo-5-methyl-
CID 5310884
2-(pyridin-2-yl)-1H-imidazo(4,5-c)pyridine
CID 947740
5-bromo-1H-pyrrolo[2,3-b]pyridine
CID 10307932
3H-Imidazo(4,5-b)pyridin-2-amine
CID 179897
Pyrrolopyrimidine
CID 577022

Frequently Asked Questions

What is the IUPAC name of 7-bromo-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 7-bromo-1H-imidazo[4,5-b]pyridine (CID 53423966) is 7-bromo-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 7-bromo-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 7-bromo-1H-imidazo[4,5-b]pyridine is Brc1ccnc2nc[nH]c12.
What is the InChIKey of 7-bromo-1H-imidazo[4,5-b]pyridine?
The InChIKey is DEFSPWZHYXXHLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrN3/c7-4-1-2-8-6-5(4)9-3-10-6/h1-3H,(H,8,9,10).
What are the key properties of 7-bromo-1H-imidazo[4,5-b]pyridine?
7-bromo-1H-imidazo[4,5-b]pyridine has a molecular weight of 198.02 g/mol, XLogP of 1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 53423966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).