3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine

C13H12N4O2 — CID 67241302

IUPAC3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
SMILESCOc1cc(OC)nc(-c2cnc3ccccn23)n1
InChIInChI=1S/C13H12N4O2/c1-18-11-7-12(19-2)16-13(15-11)9-8-14-10-5-3-4-6-17(9)10/h3-8H,1-2H3
InChIKeyLIRGZOCICRFASB-UHFFFAOYSA-N
MW256.26 g/mol
LogP1.81
Rot. Bonds3

About 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine

3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine (PubChem CID 67241302) has the molecular formula C13H12N4O2 and a molecular weight of 256.26 g/mol. Its IUPAC name is 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
PubChem CID67241302
Molecular FormulaC13H12N4O2
Molecular Weight256.26 g/mol
Exact Mass256.10
IUPAC Name3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
SMILESCOc1cc(OC)nc(-c2cnc3ccccn23)n1
InChIInChI=1S/C13H12N4O2/c1-18-11-7-12(19-2)16-13(15-11)9-8-14-10-5-3-4-6-17(9)10/h3-8H,1-2H3
InChIKeyLIRGZOCICRFASB-UHFFFAOYSA-N
XLogP1.81
TPSA61.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine (CID 67241302) is 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine is COc1cc(OC)nc(-c2cnc3ccccn23)n1.
What is the InChIKey of 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is LIRGZOCICRFASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2/c1-18-11-7-12(19-2)16-13(15-11)9-8-14-10-5-3-4-6-17(9)10/h3-8H,1-2H3.
What are the key properties of 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 256.26 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,6-dimethoxypyrimidin-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 67241302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).