5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine

C13H8BrFN2 — CID 117142181

IUPAC5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine
SMILESFc1cccc(-c2ncc3cccc(Br)n23)c1
InChIInChI=1S/C13H8BrFN2/c14-12-6-2-5-11-8-16-13(17(11)12)9-3-1-4-10(15)7-9/h1-8H
InChIKeyJJZLZASPTLBOQO-UHFFFAOYSA-N
MW291.12 g/mol
LogP3.90
Rot. Bonds1

About 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine

5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine (PubChem CID 117142181) has the molecular formula C13H8BrFN2 and a molecular weight of 291.12 g/mol. Its IUPAC name is 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine
PubChem CID117142181
Molecular FormulaC13H8BrFN2
Molecular Weight291.12 g/mol
Exact Mass289.99
IUPAC Name5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine
SMILESFc1cccc(-c2ncc3cccc(Br)n23)c1
InChIInChI=1S/C13H8BrFN2/c14-12-6-2-5-11-8-16-13(17(11)12)9-3-1-4-10(15)7-9/h1-8H
InChIKeyJJZLZASPTLBOQO-UHFFFAOYSA-N
XLogP3.90
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.12
LogP ≤ 53.90
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

3-(3-fluorophenyl)-5-methylimidazo[1,5-a]pyridine
CID 117142169
5-methyl-3-(3-methylphenyl)imidazo[1,5-a]pyridine
CID 117142160
5-chloro-3-(3-methylphenyl)imidazo[1,5-a]pyridine
CID 117142163
5-bromo-2-(3-fluorophenyl)-1H-imidazole
CID 117259232
3-(5-chloroimidazo[1,5-a]pyridin-3-yl)phenol
CID 117142200
3-bromo-7-(3-fluorophenyl)imidazo[1,2-b]pyridazine
CID 66812841
1-butyl-5-ethyl-2-(3-fluorophenyl)imidazole
CID 142148555
3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine-5-carbaldehyde
CID 117141165
3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-5-carboxylic acid
CID 84737927
3-(3-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 117149032
5-bromo-2-(3-fluorophenyl)-1H-pyrimidine-6-thione
CID 106480791
5-(3-fluorophenyl)-1H-1,2,4-triazole
CID 53264352

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine?
The IUPAC name of 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine (CID 117142181) is 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine is Fc1cccc(-c2ncc3cccc(Br)n23)c1.
What is the InChIKey of 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine?
The InChIKey is JJZLZASPTLBOQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrFN2/c14-12-6-2-5-11-8-16-13(17(11)12)9-3-1-4-10(15)7-9/h1-8H.
What are the key properties of 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine?
5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine has a molecular weight of 291.12 g/mol, XLogP of 3.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 117142181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).