3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C24H22N4O2 — CID 109070418

IUPAC3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCc1ccc(NC(=O)c2nc(C(=O)NC(C)c3ccccc3)c3ccccn23)cc1
InChIInChI=1S/C24H22N4O2/c1-16-11-13-19(14-12-16)26-24(30)22-27-21(20-10-6-7-15-28(20)22)23(29)25-17(2)18-8-4-3-5-9-18/h3-15,17H,1-2H3,(H,25,29)(H,26,30)
InChIKeyQHCNKKZKPVKDFC-UHFFFAOYSA-N
MW398.47 g/mol
LogP4.39
Rot. Bonds5

About 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109070418) has the molecular formula C24H22N4O2 and a molecular weight of 398.47 g/mol. Its IUPAC name is 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109070418
Molecular FormulaC24H22N4O2
Molecular Weight398.47 g/mol
Exact Mass398.17
IUPAC Name3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCc1ccc(NC(=O)c2nc(C(=O)NC(C)c3ccccc3)c3ccccn23)cc1
InChIInChI=1S/C24H22N4O2/c1-16-11-13-19(14-12-16)26-24(30)22-27-21(20-10-6-7-15-28(20)22)23(29)25-17(2)18-8-4-3-5-9-18/h3-15,17H,1-2H3,(H,25,29)(H,26,30)
InChIKeyQHCNKKZKPVKDFC-UHFFFAOYSA-N
XLogP4.39
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-(4-methylphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066397
3-N-(3-methylphenyl)-1-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071926
1-N-benzyl-3-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070223
3-N-benzyl-1-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070283
1-N-(2,4-dimethylphenyl)-3-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071966
3-N-methyl-3-N-phenyl-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070419
1-N-(2-ethylphenyl)-3-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071972
3-N-(4-methylphenyl)-1-N-(pyridin-4-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070723
1-N-(4-methylphenyl)-3-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067033
3-N-butan-2-yl-1-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067826
3-N-(4-methylphenyl)-1-N,1-N-dipropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071668
1-N-butan-2-yl-3-N-(4-cyanophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067760

Frequently Asked Questions

What is the IUPAC name of 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109070418) is 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is Cc1ccc(NC(=O)c2nc(C(=O)NC(C)c3ccccc3)c3ccccn23)cc1.
What is the InChIKey of 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is QHCNKKZKPVKDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O2/c1-16-11-13-19(14-12-16)26-24(30)22-27-21(20-10-6-7-15-28(20)22)23(29)25-17(2)18-8-4-3-5-9-18/h3-15,17H,1-2H3,(H,25,29)(H,26,30).
What are the key properties of 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 398.47 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(4-methylphenyl)-1-N-(1-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109070418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).