3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C24H22N4O2 — CID 109070292

IUPAC3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1nc(C(=O)NCc2ccccc2)n2ccccc12
InChIInChI=1S/C24H22N4O2/c1-2-18-12-6-7-13-19(18)26-23(29)21-20-14-8-9-15-28(20)22(27-21)24(30)25-16-17-10-4-3-5-11-17/h3-15H,2,16H2,1H3,(H,25,30)(H,26,29)
InChIKeyYIUDFSPAOHJWAW-UHFFFAOYSA-N
MW398.47 g/mol
LogP4.08
Rot. Bonds6

About 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109070292) has the molecular formula C24H22N4O2 and a molecular weight of 398.47 g/mol. Its IUPAC name is 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109070292
Molecular FormulaC24H22N4O2
Molecular Weight398.47 g/mol
Exact Mass398.17
IUPAC Name3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1nc(C(=O)NCc2ccccc2)n2ccccc12
InChIInChI=1S/C24H22N4O2/c1-2-18-12-6-7-13-19(18)26-23(29)21-20-14-8-9-15-28(20)22(27-21)24(30)25-16-17-10-4-3-5-11-17/h3-15H,2,16H2,1H3,(H,25,30)(H,26,29)
InChIKeyYIUDFSPAOHJWAW-UHFFFAOYSA-N
XLogP4.08
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-N,3-N-diethyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070989
3-N-benzyl-1-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070283
1-N-(2-ethylphenyl)-3-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071972
3-N-(2-ethylphenyl)-1-N-pentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071374
1-N-benzyl-3-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070239
3-N-(2-ethylphenyl)-1-N-methyl-1-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071990
ethyl 4-[[3-(benzylcarbamoyl)imidazo[1,5-a]pyridine-1-carbonyl]amino]benzoate
CID 165367492
3-N-(2-ethylphenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109072032
3-N-(2-methylphenyl)-1-N-[(2-methylphenyl)methyl]imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070314
3-N-benzyl-1-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070267
3-N-benzyl-1-N-(3-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070297
1-N-(2-fluorophenyl)-3-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070701

Frequently Asked Questions

What is the IUPAC name of 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109070292) is 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is CCc1ccccc1NC(=O)c1nc(C(=O)NCc2ccccc2)n2ccccc12.
What is the InChIKey of 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is YIUDFSPAOHJWAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O2/c1-2-18-12-6-7-13-19(18)26-23(29)21-20-14-8-9-15-28(20)22(27-21)24(30)25-16-17-10-4-3-5-11-17/h3-15H,2,16H2,1H3,(H,25,30)(H,26,29).
What are the key properties of 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 398.47 g/mol, XLogP of 4.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-benzyl-1-N-(2-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109070292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).