6-tert-butyl-5-chloroimidazo[1,2-a]pyridine

C11H13ClN2 — CID 146326299

IUPAC6-tert-butyl-5-chloroimidazo[1,2-a]pyridine
SMILESCC(C)(C)c1ccc2nccn2c1Cl
InChIInChI=1S/C11H13ClN2/c1-11(2,3)8-4-5-9-13-6-7-14(9)10(8)12/h4-7H,1-3H3
InChIKeyZALCDMZNEVVNJQ-UHFFFAOYSA-N
MW208.69 g/mol
LogP3.29
Rot. Bonds

About 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine

6-tert-butyl-5-chloroimidazo[1,2-a]pyridine (PubChem CID 146326299) has the molecular formula C11H13ClN2 and a molecular weight of 208.69 g/mol. Its IUPAC name is 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-tert-butyl-5-chloroimidazo[1,2-a]pyridine
PubChem CID146326299
Molecular FormulaC11H13ClN2
Molecular Weight208.69 g/mol
Exact Mass208.08
IUPAC Name6-tert-butyl-5-chloroimidazo[1,2-a]pyridine
SMILESCC(C)(C)c1ccc2nccn2c1Cl
InChIInChI=1S/C11H13ClN2/c1-11(2,3)8-4-5-9-13-6-7-14(9)10(8)12/h4-7H,1-3H3
InChIKeyZALCDMZNEVVNJQ-UHFFFAOYSA-N
XLogP3.29
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.69
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-tert-butyl-5-chloroimidazo[1,2-a]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-tert-butyl-5-chloroimidazo[1,2-a]pyridine?
The IUPAC name of 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine (CID 146326299) is 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine?
The canonical SMILES for 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine is CC(C)(C)c1ccc2nccn2c1Cl.
What is the InChIKey of 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine?
The InChIKey is ZALCDMZNEVVNJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2/c1-11(2,3)8-4-5-9-13-6-7-14(9)10(8)12/h4-7H,1-3H3.
What are the key properties of 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine?
6-tert-butyl-5-chloroimidazo[1,2-a]pyridine has a molecular weight of 208.69 g/mol, XLogP of 3.29, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-5-chloroimidazo[1,2-a]pyridine is sourced from PubChem (CID 146326299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).