4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide

C23H21N3O3 — CID 109092310

IUPAC4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(C(C)=O)cc3)ccn2)cc1
InChIInChI=1S/C23H21N3O3/c1-3-16-4-8-19(9-5-16)26-23(29)21-14-18(12-13-24-21)22(28)25-20-10-6-17(7-11-20)15(2)27/h4-14H,3H2,1-2H3,(H,25,28)(H,26,29)
InChIKeySUCNIPQLYCFJJS-UHFFFAOYSA-N
MW387.44 g/mol
LogP4.35
Rot. Bonds6

About 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide

4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092310) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092310
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC Name4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(C(C)=O)cc3)ccn2)cc1
InChIInChI=1S/C23H21N3O3/c1-3-16-4-8-19(9-5-16)26-23(29)21-14-18(12-13-24-21)22(28)25-20-10-6-17(7-11-20)15(2)27/h4-14H,3H2,1-2H3,(H,25,28)(H,26,29)
InChIKeySUCNIPQLYCFJJS-UHFFFAOYSA-N
XLogP4.35
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide (CID 109092310) is 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide is CCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(C(C)=O)cc3)ccn2)cc1.
What is the InChIKey of 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is SUCNIPQLYCFJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-3-16-4-8-19(9-5-16)26-23(29)21-14-18(12-13-24-21)22(28)25-20-10-6-17(7-11-20)15(2)27/h4-14H,3H2,1-2H3,(H,25,28)(H,26,29).
What are the key properties of 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide?
4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 387.44 g/mol, XLogP of 4.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).