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

C12H14BrN3O — CID 117252237

IUPAC1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine
SMILESNc1cccn2c(C3CCOCC3)nc(Br)c12
InChIInChI=1S/C12H14BrN3O/c13-11-10-9(14)2-1-5-16(10)12(15-11)8-3-6-17-7-4-8/h1-2,5,8H,3-4,6-7,14H2
InChIKeyFRNGVNKWBNZODC-UHFFFAOYSA-N
MW296.17 g/mol
LogP2.57
Rot. Bonds1

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

1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine (PubChem CID 117252237) has the molecular formula C12H14BrN3O and a molecular weight of 296.17 g/mol. Its IUPAC name is 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine
PubChem CID117252237
Molecular FormulaC12H14BrN3O
Molecular Weight296.17 g/mol
Exact Mass295.03
IUPAC Name1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine
SMILESNc1cccn2c(C3CCOCC3)nc(Br)c12
InChIInChI=1S/C12H14BrN3O/c13-11-10-9(14)2-1-5-16(10)12(15-11)8-3-6-17-7-4-8/h1-2,5,8H,3-4,6-7,14H2
InChIKeyFRNGVNKWBNZODC-UHFFFAOYSA-N
XLogP2.57
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.17
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-bromo-3-piperidin-4-ylimidazo[1,5-a]pyridin-8-amine
CID 117252248
1-bromo-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
CID 117252249
3-cyclopropyl-1-methylimidazo[1,5-a]pyridin-8-amine
CID 83829000
1-chloro-8-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyridine
CID 117252272
1-bromo-8-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744303
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-8-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine;ethyl acetate
CID 71074993
1-bromo-3-cyclopentylimidazo[1,5-a]pyrazin-8-amine
CID 71222909
1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
CID 117252254
8-bromo-1-chloro-3-cyclopropylimidazo[1,5-a]pyridine
CID 83903679
1-bromo-6-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine
CID 84744388

Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine?
The IUPAC name of 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine (CID 117252237) is 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine?
The canonical SMILES for 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine is Nc1cccn2c(C3CCOCC3)nc(Br)c12.
What is the InChIKey of 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine?
The InChIKey is FRNGVNKWBNZODC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN3O/c13-11-10-9(14)2-1-5-16(10)12(15-11)8-3-6-17-7-4-8/h1-2,5,8H,3-4,6-7,14H2.
What are the key properties of 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine?
1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine has a molecular weight of 296.17 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(oxan-4-yl)imidazo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 117252237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).