3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine

C10H13BrN4 — CID 117253783

IUPAC3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine
SMILESCC(N)Cc1nc(Br)c2ccc(N)cn12
InChIInChI=1S/C10H13BrN4/c1-6(12)4-9-14-10(11)8-3-2-7(13)5-15(8)9/h2-3,5-6H,4,12-13H2,1H3
InChIKeyZMGCRNPECUMPJJ-UHFFFAOYSA-N
MW269.15 g/mol
LogP1.57
Rot. Bonds2

About 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine

3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine (PubChem CID 117253783) has the molecular formula C10H13BrN4 and a molecular weight of 269.15 g/mol. Its IUPAC name is 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound Name3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine
PubChem CID117253783
Molecular FormulaC10H13BrN4
Molecular Weight269.15 g/mol
Exact Mass268.03
IUPAC Name3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine
SMILESCC(N)Cc1nc(Br)c2ccc(N)cn12
InChIInChI=1S/C10H13BrN4/c1-6(12)4-9-14-10(11)8-3-2-7(13)5-15(8)9/h2-3,5-6H,4,12-13H2,1H3
InChIKeyZMGCRNPECUMPJJ-UHFFFAOYSA-N
XLogP1.57
TPSA69.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.15
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine?
The IUPAC name of 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine (CID 117253783) is 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine.
What is the SMILES notation for 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine?
The canonical SMILES for 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine is CC(N)Cc1nc(Br)c2ccc(N)cn12.
What is the InChIKey of 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine?
The InChIKey is ZMGCRNPECUMPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN4/c1-6(12)4-9-14-10(11)8-3-2-7(13)5-15(8)9/h2-3,5-6H,4,12-13H2,1H3.
What are the key properties of 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine?
3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine has a molecular weight of 269.15 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopropyl)-1-bromoimidazo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 117253783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).