5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine

C13H16N2O2 — CID 117140411

IUPAC5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine
SMILESCOc1cccc2cnc(C3CCOCC3)n12
InChIInChI=1S/C13H16N2O2/c1-16-12-4-2-3-11-9-14-13(15(11)12)10-5-7-17-8-6-10/h2-4,9-10H,5-8H2,1H3
InChIKeyLBONZOQRJMAVRJ-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.24
Rot. Bonds2

About 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine

5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine (PubChem CID 117140411) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine
PubChem CID117140411
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine
SMILESCOc1cccc2cnc(C3CCOCC3)n12
InChIInChI=1S/C13H16N2O2/c1-16-12-4-2-3-11-9-14-13(15(11)12)10-5-7-17-8-6-10/h2-4,9-10H,5-8H2,1H3
InChIKeyLBONZOQRJMAVRJ-UHFFFAOYSA-N
XLogP2.24
TPSA35.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine?
The IUPAC name of 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine (CID 117140411) is 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine?
The canonical SMILES for 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine is COc1cccc2cnc(C3CCOCC3)n12.
What is the InChIKey of 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine?
The InChIKey is LBONZOQRJMAVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-16-12-4-2-3-11-9-14-13(15(11)12)10-5-7-17-8-6-10/h2-4,9-10H,5-8H2,1H3.
What are the key properties of 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine?
5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine has a molecular weight of 232.28 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-(oxan-4-yl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 117140411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).