5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide

C23H21N3O3 — CID 109106239

IUPAC5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cncc(C(=O)NCCc3ccccc3)c2)cc1
InChIInChI=1S/C23H21N3O3/c1-16(27)18-7-9-21(10-8-18)26-23(29)20-13-19(14-24-15-20)22(28)25-12-11-17-5-3-2-4-6-17/h2-10,13-15H,11-12H2,1H3,(H,25,28)(H,26,29)
InChIKeyHFQDBPDIIFLNAA-UHFFFAOYSA-N
MW387.44 g/mol
LogP3.51
Rot. Bonds7

About 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide

5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide (PubChem CID 109106239) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
PubChem CID109106239
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC Name5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cncc(C(=O)NCCc3ccccc3)c2)cc1
InChIInChI=1S/C23H21N3O3/c1-16(27)18-7-9-21(10-8-18)26-23(29)20-13-19(14-24-15-20)22(28)25-12-11-17-5-3-2-4-6-17/h2-10,13-15H,11-12H2,1H3,(H,25,28)(H,26,29)
InChIKeyHFQDBPDIIFLNAA-UHFFFAOYSA-N
XLogP3.51
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-(3-methylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106204
3-N-[2-(4-fluorophenyl)ethyl]-5-N-phenylpyridine-3,5-dicarboxamide
CID 109106358
3-N-(3-acetylphenyl)-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide
CID 109055307
5-N-(4-fluorophenyl)-3-N-[2-(4-fluorophenyl)ethyl]pyridine-3,5-dicarboxamide
CID 109106374
5-N-(3-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106241
5-N-(2-fluorophenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109106222
3-N-(2-phenylethyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101366
5-N-[2-(dimethylamino)ethyl]-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109104046
3-N-(2-phenylethyl)-5-N-prop-2-enylpyridine-3,5-dicarboxamide
CID 109101755
N-(4-acetylphenyl)-2-(2-phenylethylamino)pyrimidine-5-carboxamide
CID 109259588
5-N-(3-acetylphenyl)-3-N-benzylpyridine-3,5-dicarboxamide
CID 109105062
1-[4-(4-acetylphenyl)phenyl]ethanone;4-(4-acetylphenyl)-N-(2-phenylethyl)benzamide
CID 91489702

Frequently Asked Questions

What is the IUPAC name of 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide (CID 109106239) is 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide is CC(=O)c1ccc(NC(=O)c2cncc(C(=O)NCCc3ccccc3)c2)cc1.
What is the InChIKey of 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The InChIKey is HFQDBPDIIFLNAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-16(27)18-7-9-21(10-8-18)26-23(29)20-13-19(14-24-15-20)22(28)25-12-11-17-5-3-2-4-6-17/h2-10,13-15H,11-12H2,1H3,(H,25,28)(H,26,29).
What are the key properties of 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide has a molecular weight of 387.44 g/mol, XLogP of 3.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(4-acetylphenyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109106239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).