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

C12H15N3O — CID 117141464

IUPAC3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2cnc(C3CCCOC3)n12
InChIInChI=1S/C12H15N3O/c13-11-5-1-4-10-7-14-12(15(10)11)9-3-2-6-16-8-9/h1,4-5,7,9H,2-3,6,8,13H2
InChIKeyZNJCZNSDHHCQSF-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.81
Rot. Bonds1

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

3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine (PubChem CID 117141464) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine
PubChem CID117141464
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2cnc(C3CCCOC3)n12
InChIInChI=1S/C12H15N3O/c13-11-5-1-4-10-7-14-12(15(10)11)9-3-2-6-16-8-9/h1,4-5,7,9H,2-3,6,8,13H2
InChIKeyZNJCZNSDHHCQSF-UHFFFAOYSA-N
XLogP1.81
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine?
The IUPAC name of 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine (CID 117141464) is 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine?
The canonical SMILES for 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine is Nc1cccc2cnc(C3CCCOC3)n12.
What is the InChIKey of 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine?
The InChIKey is ZNJCZNSDHHCQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c13-11-5-1-4-10-7-14-12(15(10)11)9-3-2-6-16-8-9/h1,4-5,7,9H,2-3,6,8,13H2.
What are the key properties of 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine?
3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine has a molecular weight of 217.27 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxan-3-yl)imidazo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 117141464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).