3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C21H14F2N4O2 — CID 109072044

IUPAC3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1)c1nc(C(=O)Nc2ccccc2F)n2ccccc12
InChIInChI=1S/C21H14F2N4O2/c22-13-8-10-14(11-9-13)24-20(28)18-17-7-3-4-12-27(17)19(26-18)21(29)25-16-6-2-1-5-15(16)23/h1-12H,(H,24,28)(H,25,29)
InChIKeyXHKOGWVJIHYMKK-UHFFFAOYSA-N
MW392.37 g/mol
LogP4.12
Rot. Bonds4

About 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109072044) has the molecular formula C21H14F2N4O2 and a molecular weight of 392.37 g/mol. Its IUPAC name is 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109072044
Molecular FormulaC21H14F2N4O2
Molecular Weight392.37 g/mol
Exact Mass392.11
IUPAC Name3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1)c1nc(C(=O)Nc2ccccc2F)n2ccccc12
InChIInChI=1S/C21H14F2N4O2/c22-13-8-10-14(11-9-13)24-20(28)18-17-7-3-4-12-27(17)19(26-18)21(29)25-16-6-2-1-5-15(16)23/h1-12H,(H,24,28)(H,25,29)
InChIKeyXHKOGWVJIHYMKK-UHFFFAOYSA-N
XLogP4.12
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.37
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-(2-fluorophenyl)-1-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067464
1-N-[2-(dimethylamino)ethyl]-3-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109069629
3-N-(2-fluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109072049
1-N-(3-fluorophenyl)-3-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071855
3-N-(2-fluorophenyl)-1-N-(pyridin-4-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070735
3-N-(2-fluorophenyl)-1-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070597
1-N-(2-ethylphenyl)-3-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071972
1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066620
1-N-(2,4-dimethylphenyl)-3-N-(4-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071966
1-N-(2-fluorophenyl)-3-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109070701
1-N-(3,5-dimethylphenyl)-3-N-(2-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071893
3-N-(4-chlorophenyl)-1-N-propylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109065952

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109072044) is 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is O=C(Nc1ccc(F)cc1)c1nc(C(=O)Nc2ccccc2F)n2ccccc12.
What is the InChIKey of 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is XHKOGWVJIHYMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14F2N4O2/c22-13-8-10-14(11-9-13)24-20(28)18-17-7-3-4-12-27(17)19(26-18)21(29)25-16-6-2-1-5-15(16)23/h1-12H,(H,24,28)(H,25,29).
What are the key properties of 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 392.37 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109072044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).