5-bromo-1,3-dimethylimidazo[1,5-a]pyridine

C9H9BrN2 — CID 83839586

IUPAC5-bromo-1,3-dimethylimidazo[1,5-a]pyridine
SMILESCc1nc(C)n2c(Br)cccc12
InChIInChI=1S/C9H9BrN2/c1-6-8-4-3-5-9(10)12(8)7(2)11-6/h3-5H,1-2H3
InChIKeyLZZKFEUUULDBAD-UHFFFAOYSA-N
MW225.09 g/mol
LogP2.71
Rot. Bonds

About 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine

5-bromo-1,3-dimethylimidazo[1,5-a]pyridine (PubChem CID 83839586) has the molecular formula C9H9BrN2 and a molecular weight of 225.09 g/mol. Its IUPAC name is 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name5-bromo-1,3-dimethylimidazo[1,5-a]pyridine
PubChem CID83839586
Molecular FormulaC9H9BrN2
Molecular Weight225.09 g/mol
Exact Mass223.99
IUPAC Name5-bromo-1,3-dimethylimidazo[1,5-a]pyridine
SMILESCc1nc(C)n2c(Br)cccc12
InChIInChI=1S/C9H9BrN2/c1-6-8-4-3-5-9(10)12(8)7(2)11-6/h3-5H,1-2H3
InChIKeyLZZKFEUUULDBAD-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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Related Compounds

1,5-dibromo-3-ethylimidazo[1,5-a]pyridine
CID 84744172
5-bromo-3-(chloromethyl)-2-methylimidazo[1,2-a]pyridine
CID 82060520
1-bromo-N,3-dimethylimidazo[1,5-a]pyridin-5-amine
CID 83898792
1-(5-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 83843959
5-N,5-N,1-trimethylimidazo[1,5-a]pyridine-3,5-diamine
CID 83877578
5-bromo-3-tert-butylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743489
1-(5-bromo-3-ethylimidazo[1,5-a]pyridin-1-yl)-N-methylmethanamine
CID 83867452
3-chloro-1-methylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 83834906
ethyl 5-bromo-2-methylimidazo[1,2-a]pyridine-3-carboxylate
CID 130113655
1-bromo-3-tert-butylimidazo[1,5-a]pyridin-5-amine
CID 83844677
5-bromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743818
N,1,3-trimethylimidazo[1,5-a]quinoxalin-4-amine
CID 59956398

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine?
The IUPAC name of 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine (CID 83839586) is 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine.
What is the SMILES notation for 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine?
The canonical SMILES for 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine is Cc1nc(C)n2c(Br)cccc12.
What is the InChIKey of 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine?
The InChIKey is LZZKFEUUULDBAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2/c1-6-8-4-3-5-9(10)12(8)7(2)11-6/h3-5H,1-2H3.
What are the key properties of 5-bromo-1,3-dimethylimidazo[1,5-a]pyridine?
5-bromo-1,3-dimethylimidazo[1,5-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-1,3-dimethylimidazo[1,5-a]pyridine is sourced from PubChem (CID 83839586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).