1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C21H24N4O2 — CID 109071079

IUPAC1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCCc1ccc(NC(=O)c2nc(C(=O)NC(C)(C)C)c3ccccn23)cc1
InChIInChI=1S/C21H24N4O2/c1-5-14-9-11-15(12-10-14)22-20(27)18-23-17(19(26)24-21(2,3)4)16-8-6-7-13-25(16)18/h6-13H,5H2,1-4H3,(H,22,27)(H,24,26)
InChIKeyQMTICJMQFCTYFB-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.68
Rot. Bonds4

About 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109071079) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109071079
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCCc1ccc(NC(=O)c2nc(C(=O)NC(C)(C)C)c3ccccn23)cc1
InChIInChI=1S/C21H24N4O2/c1-5-14-9-11-15(12-10-14)22-20(27)18-23-17(19(26)24-21(2,3)4)16-8-6-7-13-25(16)18/h6-13H,5H2,1-4H3,(H,22,27)(H,24,26)
InChIKeyQMTICJMQFCTYFB-UHFFFAOYSA-N
XLogP3.68
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-(4-ethylphenyl)-1-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066252
1-N-tert-butyl-3-N-[4-(dimethylamino)phenyl]imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071118
3-N-(4-ethylphenyl)-1-N-(2-methoxyethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068925
1-N-[3-(dimethylamino)propyl]-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109069806
1-N-(4-ethylphenyl)-3-N-methyl-3-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109072008
1-N-tert-butyl-3-N,3-N-diethylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070965
1-N-tert-butyl-3-N-(2-phenylethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070790
1-N-butyl-3-N-(4-tert-butylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067203
1-N-butyl-3-N-tert-butylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067169
N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068805
3-N-butyl-1-N-(4-ethylphenyl)-3-N-methylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071536
1-N-(4-tert-butylphenyl)-3-N-propylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066104

Frequently Asked Questions

What is the IUPAC name of 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109071079) is 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is CCc1ccc(NC(=O)c2nc(C(=O)NC(C)(C)C)c3ccccn23)cc1.
What is the InChIKey of 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is QMTICJMQFCTYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-5-14-9-11-15(12-10-14)22-20(27)18-23-17(19(26)24-21(2,3)4)16-8-6-7-13-25(16)18/h6-13H,5H2,1-4H3,(H,22,27)(H,24,26).
What are the key properties of 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-tert-butyl-3-N-(4-ethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109071079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).