1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine

C10H12BrN3 — CID 83867538

IUPAC1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine
SMILESCc1nc(C(C)N)n2cc(Br)ccc12
InChIInChI=1S/C10H12BrN3/c1-6(12)10-13-7(2)9-4-3-8(11)5-14(9)10/h3-6H,12H2,1-2H3
InChIKeyHKTCIOCVFIVYFJ-UHFFFAOYSA-N
MW254.13 g/mol
LogP2.42
Rot. Bonds1

About 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine

1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine (PubChem CID 83867538) has the molecular formula C10H12BrN3 and a molecular weight of 254.13 g/mol. Its IUPAC name is 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine.

Molecular Properties

Compound Name1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine
PubChem CID83867538
Molecular FormulaC10H12BrN3
Molecular Weight254.13 g/mol
Exact Mass253.02
IUPAC Name1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine
SMILESCc1nc(C(C)N)n2cc(Br)ccc12
InChIInChI=1S/C10H12BrN3/c1-6(12)10-13-7(2)9-4-3-8(11)5-14(9)10/h3-6H,12H2,1-2H3
InChIKeyHKTCIOCVFIVYFJ-UHFFFAOYSA-N
XLogP2.42
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.13
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine?
The IUPAC name of 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine (CID 83867538) is 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine.
What is the SMILES notation for 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine?
The canonical SMILES for 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine is Cc1nc(C(C)N)n2cc(Br)ccc12.
What is the InChIKey of 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine?
The InChIKey is HKTCIOCVFIVYFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN3/c1-6(12)10-13-7(2)9-4-3-8(11)5-14(9)10/h3-6H,12H2,1-2H3.
What are the key properties of 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine?
1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine has a molecular weight of 254.13 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-1-methylimidazo[1,5-a]pyridin-3-yl)ethanamine is sourced from PubChem (CID 83867538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).