5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide

C23H23N3O2 — CID 109105347

IUPAC5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
SMILESCC(NC(=O)c1cncc(C(=O)NCCc2ccccc2)c1)c1ccccc1
InChIInChI=1S/C23H23N3O2/c1-17(19-10-6-3-7-11-19)26-23(28)21-14-20(15-24-16-21)22(27)25-13-12-18-8-4-2-5-9-18/h2-11,14-17H,12-13H2,1H3,(H,25,27)(H,26,28)
InChIKeyZZKIGNGKURZALH-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.55
Rot. Bonds7

About 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide

5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide (PubChem CID 109105347) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
PubChem CID109105347
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
SMILESCC(NC(=O)c1cncc(C(=O)NCCc2ccccc2)c1)c1ccccc1
InChIInChI=1S/C23H23N3O2/c1-17(19-10-6-3-7-11-19)26-23(28)21-14-20(15-24-16-21)22(27)25-13-12-18-8-4-2-5-9-18/h2-11,14-17H,12-13H2,1H3,(H,25,27)(H,26,28)
InChIKeyZZKIGNGKURZALH-UHFFFAOYSA-N
XLogP3.55
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide (CID 109105347) is 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide is CC(NC(=O)c1cncc(C(=O)NCCc2ccccc2)c1)c1ccccc1.
What is the InChIKey of 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
The InChIKey is ZZKIGNGKURZALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-17(19-10-6-3-7-11-19)26-23(28)21-14-20(15-24-16-21)22(27)25-13-12-18-8-4-2-5-9-18/h2-11,14-17H,12-13H2,1H3,(H,25,27)(H,26,28).
What are the key properties of 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide?
5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide has a molecular weight of 373.46 g/mol, XLogP of 3.55, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(1-phenylethyl)-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).