1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine

C13H17BrN4 — CID 117252249

IUPAC1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
SMILESCN1CCC(c2nc(Br)c3c(N)cccn23)CC1
InChIInChI=1S/C13H17BrN4/c1-17-7-4-9(5-8-17)13-16-12(14)11-10(15)3-2-6-18(11)13/h2-3,6,9H,4-5,7-8,15H2,1H3
InChIKeyFIXOFKGZVIQASM-UHFFFAOYSA-N
MW309.21 g/mol
LogP2.49
Rot. Bonds1

About 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine

1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine (PubChem CID 117252249) has the molecular formula C13H17BrN4 and a molecular weight of 309.21 g/mol. Its IUPAC name is 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
PubChem CID117252249
Molecular FormulaC13H17BrN4
Molecular Weight309.21 g/mol
Exact Mass308.06
IUPAC Name1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
SMILESCN1CCC(c2nc(Br)c3c(N)cccn23)CC1
InChIInChI=1S/C13H17BrN4/c1-17-7-4-9(5-8-17)13-16-12(14)11-10(15)3-2-6-18(11)13/h2-3,6,9H,4-5,7-8,15H2,1H3
InChIKeyFIXOFKGZVIQASM-UHFFFAOYSA-N
XLogP2.49
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.21
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-bromo-8-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744303
1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine
CID 117252237
1-bromo-3-piperidin-4-ylimidazo[1,5-a]pyridin-8-amine
CID 117252248
3-cyclopropyl-1-methylimidazo[1,5-a]pyridin-8-amine
CID 83829000
1-chloro-8-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 117252276
1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
CID 117252254
1-bromo-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117250339
3-cyclopropyl-1-nitroimidazo[1,5-a]pyridin-8-amine
CID 83836399
2-(1-bromo-3-cyclopropylimidazo[1,5-a]pyridin-8-yl)acetaldehyde
CID 83904625
1-bromo-3-propylimidazo[1,5-a]pyridin-8-amine
CID 117252409
1-chloro-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridin-8-ol
CID 117252180
1-bromo-5-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744309

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
The IUPAC name of 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine (CID 117252249) is 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
The canonical SMILES for 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine is CN1CCC(c2nc(Br)c3c(N)cccn23)CC1.
What is the InChIKey of 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
The InChIKey is FIXOFKGZVIQASM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17BrN4/c1-17-7-4-9(5-8-17)13-16-12(14)11-10(15)3-2-6-18(11)13/h2-3,6,9H,4-5,7-8,15H2,1H3.
What are the key properties of 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine has a molecular weight of 309.21 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 117252249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).