1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine

C14H10BrClN2 — CID 84744696

IUPAC1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine
SMILESCc1cccc2c(Br)nc(-c3cccc(Cl)c3)n12
InChIInChI=1S/C14H10BrClN2/c1-9-4-2-7-12-13(15)17-14(18(9)12)10-5-3-6-11(16)8-10/h2-8H,1H3
InChIKeyUPDMBTKXBHCQEV-UHFFFAOYSA-N
MW321.61 g/mol
LogP4.73
Rot. Bonds1

About 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine

1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine (PubChem CID 84744696) has the molecular formula C14H10BrClN2 and a molecular weight of 321.61 g/mol. Its IUPAC name is 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine
PubChem CID84744696
Molecular FormulaC14H10BrClN2
Molecular Weight321.61 g/mol
Exact Mass319.97
IUPAC Name1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine
SMILESCc1cccc2c(Br)nc(-c3cccc(Cl)c3)n12
InChIInChI=1S/C14H10BrClN2/c1-9-4-2-7-12-13(15)17-14(18(9)12)10-5-3-6-11(16)8-10/h2-8H,1H3
InChIKeyUPDMBTKXBHCQEV-UHFFFAOYSA-N
XLogP4.73
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.61
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine (CID 84744696) is 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine is Cc1cccc2c(Br)nc(-c3cccc(Cl)c3)n12.
What is the InChIKey of 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine?
The InChIKey is UPDMBTKXBHCQEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClN2/c1-9-4-2-7-12-13(15)17-14(18(9)12)10-5-3-6-11(16)8-10/h2-8H,1H3.
What are the key properties of 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine?
1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine has a molecular weight of 321.61 g/mol, XLogP of 4.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine is sourced from PubChem (CID 84744696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).