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

C13H10BrN3O — CID 113296104

IUPAC2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1cc(Br)ccc1-c1nc2ncccc2[nH]1
InChIInChI=1S/C13H10BrN3O/c1-18-11-7-8(14)4-5-9(11)12-16-10-3-2-6-15-13(10)17-12/h2-7H,1H3,(H,15,16,17)
InChIKeyWWRGVEKYGWXUSB-UHFFFAOYSA-N
MW304.15 g/mol
LogP3.40
Rot. Bonds2

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

2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 113296104) has the molecular formula C13H10BrN3O and a molecular weight of 304.15 g/mol. Its IUPAC name is 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
PubChem CID113296104
Molecular FormulaC13H10BrN3O
Molecular Weight304.15 g/mol
Exact Mass303.00
IUPAC Name2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1cc(Br)ccc1-c1nc2ncccc2[nH]1
InChIInChI=1S/C13H10BrN3O/c1-18-11-7-8(14)4-5-9(11)12-16-10-3-2-6-15-13(10)17-12/h2-7H,1H3,(H,15,16,17)
InChIKeyWWRGVEKYGWXUSB-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

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4,6-dimethoxy-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 14369069
4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol
CID 154667096
4-(6-bromo-1H-benzimidazol-2-yl)-3-methoxyaniline
CID 107209077
[2-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl] acetate
CID 10083598
2-(3-methoxy-2-prop-2-ynoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 19822064
[2-(1H-imidazo[4,5-b]pyridin-2-yl)-5-methoxyphenyl] N-sulfanyloxypropanimidate
CID 88664724
2-(3-propan-2-yloxynaphthalen-2-yl)-1H-imidazo[4,5-b]pyridine
CID 13304825
2-(2-ethoxy-4-prop-2-ynoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 19822069
2-(5-fluoro-2-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 55144799
2-(5-chloro-2-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 82883627
2-(3,5-dimethoxy-4-prop-2-ynoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 13121469
2-(3-methoxy-5-methylsulfinylthiophen-2-yl)-1H-imidazo[4,5-b]pyridine;hydrochloride
CID 23316754

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine (CID 113296104) is 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine is COc1cc(Br)ccc1-c1nc2ncccc2[nH]1.
What is the InChIKey of 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is WWRGVEKYGWXUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN3O/c1-18-11-7-8(14)4-5-9(11)12-16-10-3-2-6-15-13(10)17-12/h2-7H,1H3,(H,15,16,17).
What are the key properties of 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine?
2-(4-bromo-2-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 2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 113296104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).