1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine

C15H13BrN2 — CID 84744102

IUPAC1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine
SMILESCc1ccc(-c2nc(Br)c3cc(C)ccn23)cc1
InChIInChI=1S/C15H13BrN2/c1-10-3-5-12(6-4-10)15-17-14(16)13-9-11(2)7-8-18(13)15/h3-9H,1-2H3
InChIKeyZRAUOKPXYULQEB-UHFFFAOYSA-N
MW301.19 g/mol
LogP4.38
Rot. Bonds1

About 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine

1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine (PubChem CID 84744102) has the molecular formula C15H13BrN2 and a molecular weight of 301.19 g/mol. Its IUPAC name is 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine
PubChem CID84744102
Molecular FormulaC15H13BrN2
Molecular Weight301.19 g/mol
Exact Mass300.03
IUPAC Name1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine
SMILESCc1ccc(-c2nc(Br)c3cc(C)ccn23)cc1
InChIInChI=1S/C15H13BrN2/c1-10-3-5-12(6-4-10)15-17-14(16)13-9-11(2)7-8-18(13)15/h3-9H,1-2H3
InChIKeyZRAUOKPXYULQEB-UHFFFAOYSA-N
XLogP4.38
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.19
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine (CID 84744102) is 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine is Cc1ccc(-c2nc(Br)c3cc(C)ccn23)cc1.
What is the InChIKey of 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine?
The InChIKey is ZRAUOKPXYULQEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2/c1-10-3-5-12(6-4-10)15-17-14(16)13-9-11(2)7-8-18(13)15/h3-9H,1-2H3.
What are the key properties of 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine?
1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine has a molecular weight of 301.19 g/mol, XLogP of 4.38, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 84744102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).