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

C14H18BrN3 — CID 56839810

IUPAC6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine
SMILESBrc1cnc2nc(CCC3CCCCC3)[nH]c2c1
InChIInChI=1S/C14H18BrN3/c15-11-8-12-14(16-9-11)18-13(17-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,16,17,18)
InChIKeyRZPZXYGWFIJOGA-UHFFFAOYSA-N
MW308.22 g/mol
LogP4.23
Rot. Bonds3

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

6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 56839810) has the molecular formula C14H18BrN3 and a molecular weight of 308.22 g/mol. Its IUPAC name is 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID56839810
Molecular FormulaC14H18BrN3
Molecular Weight308.22 g/mol
Exact Mass307.07
IUPAC Name6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine
SMILESBrc1cnc2nc(CCC3CCCCC3)[nH]c2c1
InChIInChI=1S/C14H18BrN3/c15-11-8-12-14(16-9-11)18-13(17-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,16,17,18)
InChIKeyRZPZXYGWFIJOGA-UHFFFAOYSA-N
XLogP4.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.22
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-bromo-2-(2-cyclohexylethyl)-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

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine (CID 56839810) is 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine is Brc1cnc2nc(CCC3CCCCC3)[nH]c2c1.
What is the InChIKey of 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is RZPZXYGWFIJOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrN3/c15-11-8-12-14(16-9-11)18-13(17-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,16,17,18).
What are the key properties of 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine?
6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 308.22 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2-cyclohexylethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 56839810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).