4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide

C24H25N3O2 — CID 109085931

IUPAC4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccnc(C(=O)NCc2ccc(C)cc2)c1
InChIInChI=1S/C24H25N3O2/c1-3-27(17-20-7-5-4-6-8-20)24(29)21-13-14-25-22(15-21)23(28)26-16-19-11-9-18(2)10-12-19/h4-15H,3,16-17H2,1-2H3,(H,26,28)
InChIKeyBZRFTYWJLRFABQ-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.98
Rot. Bonds7

About 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide

4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide (PubChem CID 109085931) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide
PubChem CID109085931
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccnc(C(=O)NCc2ccc(C)cc2)c1
InChIInChI=1S/C24H25N3O2/c1-3-27(17-20-7-5-4-6-8-20)24(29)21-13-14-25-22(15-21)23(28)26-16-19-11-9-18(2)10-12-19/h4-15H,3,16-17H2,1-2H3,(H,26,28)
InChIKeyBZRFTYWJLRFABQ-UHFFFAOYSA-N
XLogP3.98
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-benzyl-4-N-ethyl-2-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085601
2-N-benzyl-2-N-ethyl-4-N-[(3-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085684
5-N-benzyl-5-N-ethyl-3-N-[(4-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105262
4-N-benzyl-2-N-[(4-fluorophenyl)methyl]-4-N-methylpyridine-2,4-dicarboxamide
CID 109086169
4-N-benzyl-2-N-[(4-chlorophenyl)methyl]-4-N-methylpyridine-2,4-dicarboxamide
CID 109086171
4-N-benzyl-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109085321
1-benzyl-1-ethyl-3-[(4-methylphenyl)methyl]urea
CID 108899084
2-N-benzyl-4-N-(3,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109085444
2-N-[(4-chlorophenyl)methyl]-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109086759
2-N-benzyl-4-N-[(4-chlorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085399
4-N-benzyl-2-N-[(4-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085281
2-N-benzyl-2-N-ethyl-4-N-pentylpyridine-2,4-dicarboxamide
CID 109087067

Frequently Asked Questions

What is the IUPAC name of 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide (CID 109085931) is 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide is CCN(Cc1ccccc1)C(=O)c1ccnc(C(=O)NCc2ccc(C)cc2)c1.
What is the InChIKey of 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
The InChIKey is BZRFTYWJLRFABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-3-27(17-20-7-5-4-6-8-20)24(29)21-13-14-25-22(15-21)23(28)26-16-19-11-9-18(2)10-12-19/h4-15H,3,16-17H2,1-2H3,(H,26,28).
What are the key properties of 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide?
4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide has a molecular weight of 387.48 g/mol, XLogP of 3.98, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-benzyl-4-N-ethyl-2-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109085931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).