dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

C18H19N3O4 — CID 14098295

IUPACdimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SMILESCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ncn2ccccc12
InChIInChI=1S/C18H19N3O4/c1-10-13(17(22)24-3)15(14(11(2)20-10)18(23)25-4)16-12-7-5-6-8-21(12)9-19-16/h5-9,15,20H,1-4H3
InChIKeyRKZABAULZNWWJB-UHFFFAOYSA-N
MW341.37 g/mol
LogP1.92
Rot. Bonds3

About dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate (PubChem CID 14098295) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.

Molecular Properties

Compound Namedimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
PubChem CID14098295
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Namedimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SMILESCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ncn2ccccc12
InChIInChI=1S/C18H19N3O4/c1-10-13(17(22)24-3)15(14(11(2)20-10)18(23)25-4)16-12-7-5-6-8-21(12)9-19-16/h5-9,15,20H,1-4H3
InChIKeyRKZABAULZNWWJB-UHFFFAOYSA-N
XLogP1.92
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate 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 dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
The IUPAC name of dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate (CID 14098295) is dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
What is the SMILES notation for dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
The canonical SMILES for dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1ncn2ccccc12.
What is the InChIKey of dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
The InChIKey is RKZABAULZNWWJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-10-13(17(22)24-3)15(14(11(2)20-10)18(23)25-4)16-12-7-5-6-8-21(12)9-19-16/h5-9,15,20H,1-4H3.
What are the key properties of dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate?
dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate has a molecular weight of 341.37 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl 4-imidazo[1,5-a]pyridin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is sourced from PubChem (CID 14098295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).