4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole

C20H19N3O3 — CID 134809657

IUPAC4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole
SMILESCOc1ccc(-c2cc(-c3c(C)noc3C)c3cncn3c2)cc1OC
InChIInChI=1S/C20H19N3O3/c1-12-20(13(2)26-22-12)16-7-15(10-23-11-21-9-17(16)23)14-5-6-18(24-3)19(8-14)25-4/h5-11H,1-4H3
InChIKeyMIFDQICPZHWATP-UHFFFAOYSA-N
MW349.39 g/mol
LogP4.29
Rot. Bonds4

About 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole

4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole (PubChem CID 134809657) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole.

Molecular Properties

Compound Name4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole
PubChem CID134809657
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole
SMILESCOc1ccc(-c2cc(-c3c(C)noc3C)c3cncn3c2)cc1OC
InChIInChI=1S/C20H19N3O3/c1-12-20(13(2)26-22-12)16-7-15(10-23-11-21-9-17(16)23)14-5-6-18(24-3)19(8-14)25-4/h5-11H,1-4H3
InChIKeyMIFDQICPZHWATP-UHFFFAOYSA-N
XLogP4.29
TPSA61.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole?
The IUPAC name of 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole (CID 134809657) is 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole.
What is the SMILES notation for 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole?
The canonical SMILES for 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole is COc1ccc(-c2cc(-c3c(C)noc3C)c3cncn3c2)cc1OC.
What is the InChIKey of 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole?
The InChIKey is MIFDQICPZHWATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-12-20(13(2)26-22-12)16-7-15(10-23-11-21-9-17(16)23)14-5-6-18(24-3)19(8-14)25-4/h5-11H,1-4H3.
What are the key properties of 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole?
4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole has a molecular weight of 349.39 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-3,5-dimethyl-1,2-oxazole is sourced from PubChem (CID 134809657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).