5-bromo-2,8-dimethylimidazo[1,2-a]pyridine

C9H9BrN2 — CID 162421604

IUPAC5-bromo-2,8-dimethylimidazo[1,2-a]pyridine
SMILESCc1cn2c(Br)ccc(C)c2n1
InChIInChI=1S/C9H9BrN2/c1-6-3-4-8(10)12-5-7(2)11-9(6)12/h3-5H,1-2H3
InChIKeyPZECVWSYFOPGTF-UHFFFAOYSA-N
MW225.09 g/mol
LogP2.71
Rot. Bonds

About 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine

5-bromo-2,8-dimethylimidazo[1,2-a]pyridine (PubChem CID 162421604) has the molecular formula C9H9BrN2 and a molecular weight of 225.09 g/mol. Its IUPAC name is 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-bromo-2,8-dimethylimidazo[1,2-a]pyridine
PubChem CID162421604
Molecular FormulaC9H9BrN2
Molecular Weight225.09 g/mol
Exact Mass223.99
IUPAC Name5-bromo-2,8-dimethylimidazo[1,2-a]pyridine
SMILESCc1cn2c(Br)ccc(C)c2n1
InChIInChI=1S/C9H9BrN2/c1-6-3-4-8(10)12-5-7(2)11-9(6)12/h3-5H,1-2H3
InChIKeyPZECVWSYFOPGTF-UHFFFAOYSA-N
XLogP2.71
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.09
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine?
The IUPAC name of 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine (CID 162421604) is 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine.
What is the SMILES notation for 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine?
The canonical SMILES for 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine is Cc1cn2c(Br)ccc(C)c2n1.
What is the InChIKey of 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine?
The InChIKey is PZECVWSYFOPGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2/c1-6-3-4-8(10)12-5-7(2)11-9(6)12/h3-5H,1-2H3.
What are the key properties of 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine?
5-bromo-2,8-dimethylimidazo[1,2-a]pyridine has a molecular weight of 225.09 g/mol, XLogP of 2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2,8-dimethylimidazo[1,2-a]pyridine is sourced from PubChem (CID 162421604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).