2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine

C9H10BrN3 — CID 83867384

IUPAC2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine
SMILESNCCc1ncn2ccc(Br)cc12
InChIInChI=1S/C9H10BrN3/c10-7-2-4-13-6-12-8(1-3-11)9(13)5-7/h2,4-6H,1,3,11H2
InChIKeyTXNRWUBQCKAWJS-UHFFFAOYSA-N
MW240.10 g/mol
LogP1.60
Rot. Bonds2

About 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine

2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine (PubChem CID 83867384) has the molecular formula C9H10BrN3 and a molecular weight of 240.10 g/mol. Its IUPAC name is 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine
PubChem CID83867384
Molecular FormulaC9H10BrN3
Molecular Weight240.10 g/mol
Exact Mass239.01
IUPAC Name2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine
SMILESNCCc1ncn2ccc(Br)cc12
InChIInChI=1S/C9H10BrN3/c10-7-2-4-13-6-12-8(1-3-11)9(13)5-7/h2,4-6H,1,3,11H2
InChIKeyTXNRWUBQCKAWJS-UHFFFAOYSA-N
XLogP1.60
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.10
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine?
The IUPAC name of 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine (CID 83867384) is 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine.
What is the SMILES notation for 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine?
The canonical SMILES for 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine is NCCc1ncn2ccc(Br)cc12.
What is the InChIKey of 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine?
The InChIKey is TXNRWUBQCKAWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN3/c10-7-2-4-13-6-12-8(1-3-11)9(13)5-7/h2,4-6H,1,3,11H2.
What are the key properties of 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine?
2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine has a molecular weight of 240.10 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-bromoimidazo[1,5-a]pyridin-1-yl)ethanamine is sourced from PubChem (CID 83867384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).