2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine

C9H9Br2N3 — CID 84744625

IUPAC2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine
SMILESNCCc1nc(Br)c2ccc(Br)cn12
InChIInChI=1S/C9H9Br2N3/c10-6-1-2-7-9(11)13-8(3-4-12)14(7)5-6/h1-2,5H,3-4,12H2
InChIKeyZPBOSJLCJLRZLO-UHFFFAOYSA-N
MW319.00 g/mol
LogP2.36
Rot. Bonds2

About 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine

2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine (PubChem CID 84744625) has the molecular formula C9H9Br2N3 and a molecular weight of 319.00 g/mol. Its IUPAC name is 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine
PubChem CID84744625
Molecular FormulaC9H9Br2N3
Molecular Weight319.00 g/mol
Exact Mass316.92
IUPAC Name2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine
SMILESNCCc1nc(Br)c2ccc(Br)cn12
InChIInChI=1S/C9H9Br2N3/c10-6-1-2-7-9(11)13-8(3-4-12)14(7)5-6/h1-2,5H,3-4,12H2
InChIKeyZPBOSJLCJLRZLO-UHFFFAOYSA-N
XLogP2.36
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.00
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine?
The IUPAC name of 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine (CID 84744625) is 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine.
What is the SMILES notation for 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine?
The canonical SMILES for 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine is NCCc1nc(Br)c2ccc(Br)cn12.
What is the InChIKey of 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine?
The InChIKey is ZPBOSJLCJLRZLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Br2N3/c10-6-1-2-7-9(11)13-8(3-4-12)14(7)5-6/h1-2,5H,3-4,12H2.
What are the key properties of 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine?
2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine has a molecular weight of 319.00 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,6-dibromoimidazo[1,5-a]pyridin-3-yl)ethanamine is sourced from PubChem (CID 84744625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).