6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide

C23H23N3O2 — CID 109100571

IUPAC6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cccc(C(=O)N(CC)c3ccccc3)n2)cc1
InChIInChI=1S/C23H23N3O2/c1-3-17-13-15-18(16-14-17)24-22(27)20-11-8-12-21(25-20)23(28)26(4-2)19-9-6-5-7-10-19/h5-16H,3-4H2,1-2H3,(H,24,27)
InChIKeyLAQCHLGLCPJMST-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.56
Rot. Bonds6

About 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide

6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide (PubChem CID 109100571) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide
PubChem CID109100571
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cccc(C(=O)N(CC)c3ccccc3)n2)cc1
InChIInChI=1S/C23H23N3O2/c1-3-17-13-15-18(16-14-17)24-22(27)20-11-8-12-21(25-20)23(28)26(4-2)19-9-6-5-7-10-19/h5-16H,3-4H2,1-2H3,(H,24,27)
InChIKeyLAQCHLGLCPJMST-UHFFFAOYSA-N
XLogP4.56
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide (CID 109100571) is 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide is CCc1ccc(NC(=O)c2cccc(C(=O)N(CC)c3ccccc3)n2)cc1.
What is the InChIKey of 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide?
The InChIKey is LAQCHLGLCPJMST-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-3-17-13-15-18(16-14-17)24-22(27)20-11-8-12-21(25-20)23(28)26(4-2)19-9-6-5-7-10-19/h5-16H,3-4H2,1-2H3,(H,24,27).
What are the key properties of 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide?
6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide has a molecular weight of 373.46 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-(4-ethylphenyl)-6-N-phenylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109100571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).