1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine

C11H13BrN2 — CID 83843869

IUPAC1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine
SMILESCc1ccc2c(Br)nc(C(C)C)n2c1
InChIInChI=1S/C11H13BrN2/c1-7(2)11-13-10(12)9-5-4-8(3)6-14(9)11/h4-7H,1-3H3
InChIKeyAZQYLEKCPCXONQ-UHFFFAOYSA-N
MW253.14 g/mol
LogP3.53
Rot. Bonds1

About 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine

1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine (PubChem CID 83843869) has the molecular formula C11H13BrN2 and a molecular weight of 253.14 g/mol. Its IUPAC name is 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine
PubChem CID83843869
Molecular FormulaC11H13BrN2
Molecular Weight253.14 g/mol
Exact Mass252.03
IUPAC Name1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine
SMILESCc1ccc2c(Br)nc(C(C)C)n2c1
InChIInChI=1S/C11H13BrN2/c1-7(2)11-13-10(12)9-5-4-8(3)6-14(9)11/h4-7H,1-3H3
InChIKeyAZQYLEKCPCXONQ-UHFFFAOYSA-N
XLogP3.53
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.14
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine?
The IUPAC name of 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine (CID 83843869) is 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine is Cc1ccc2c(Br)nc(C(C)C)n2c1.
What is the InChIKey of 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine?
The InChIKey is AZQYLEKCPCXONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2/c1-7(2)11-13-10(12)9-5-4-8(3)6-14(9)11/h4-7H,1-3H3.
What are the key properties of 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine?
1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine has a molecular weight of 253.14 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-6-methyl-3-propan-2-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 83843869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).