5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide

C24H25N3O2 — CID 109105863

IUPAC5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cncc(C(=O)Nc2cc(C)ccc2C)c1
InChIInChI=1S/C24H25N3O2/c1-4-27(16-19-8-6-5-7-9-19)24(29)21-13-20(14-25-15-21)23(28)26-22-12-17(2)10-11-18(22)3/h5-15H,4,16H2,1-3H3,(H,26,28)
InChIKeySLGOVDHGVVFTHK-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.61
Rot. Bonds6

About 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide

5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide (PubChem CID 109105863) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide
PubChem CID109105863
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cncc(C(=O)Nc2cc(C)ccc2C)c1
InChIInChI=1S/C24H25N3O2/c1-4-27(16-19-8-6-5-7-9-19)24(29)21-13-20(14-25-15-21)23(28)26-22-12-17(2)10-11-18(22)3/h5-15H,4,16H2,1-3H3,(H,26,28)
InChIKeySLGOVDHGVVFTHK-UHFFFAOYSA-N
XLogP4.61
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-benzyl-5-N-ethyl-3-N-[(4-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105262
5-N-benzyl-5-N-ethyl-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109105843
6-N-benzyl-2-N-(2,5-dimethylphenyl)-6-N-ethylpyridine-2,6-dicarboxamide
CID 109098095
5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide
CID 109103413
5-N-(2,5-dimethylphenyl)-3-N-pentylpyridine-3,5-dicarboxamide
CID 109107229
3-N-(2,3-dimethylphenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106753
3-benzamido-N-ethyl-N-[(3-fluorophenyl)methyl]-4-methylbenzamide
CID 46410054
1-N'-benzyl-1-N-(2,5-dimethylphenyl)-1-N'-ethylcyclopropane-1,1-dicarboxamide
CID 108976541
5-(2,5-dimethylanilino)-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109242839
N-(2,5-dimethylphenyl)-5-(2-ethylanilino)pyridine-3-carboxamide
CID 109242782
5-N-benzyl-3-N-(4-chloro-2-methylphenyl)-5-N-methylpyridine-3,5-dicarboxamide
CID 109105473
5-N-benzyl-3-N-(3,5-dimethylphenyl)-5-N-methylpyridine-3,5-dicarboxamide
CID 109105456

Frequently Asked Questions

What is the IUPAC name of 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide (CID 109105863) is 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide is CCN(Cc1ccccc1)C(=O)c1cncc(C(=O)Nc2cc(C)ccc2C)c1.
What is the InChIKey of 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide?
The InChIKey is SLGOVDHGVVFTHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-4-27(16-19-8-6-5-7-9-19)24(29)21-13-20(14-25-15-21)23(28)26-22-12-17(2)10-11-18(22)3/h5-15H,4,16H2,1-3H3,(H,26,28).
What are the key properties of 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide?
5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide has a molecular weight of 387.48 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).