5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide

C23H25N3O — CID 109190828

IUPAC5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccc(C)c(C)c2)nc1
InChIInChI=1S/C23H25N3O/c1-4-26(16-19-8-6-5-7-9-19)21-12-13-22(24-15-21)23(27)25-20-11-10-17(2)18(3)14-20/h5-15H,4,16H2,1-3H3,(H,25,27)
InChIKeyMXCKMNDINOKIAU-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.98
Rot. Bonds6

About 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide

5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 109190828) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
PubChem CID109190828
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccc(C)c(C)c2)nc1
InChIInChI=1S/C23H25N3O/c1-4-26(16-19-8-6-5-7-9-19)21-12-13-22(24-15-21)23(27)25-20-11-10-17(2)18(3)14-20/h5-15H,4,16H2,1-3H3,(H,25,27)
InChIKeyMXCKMNDINOKIAU-UHFFFAOYSA-N
XLogP4.98
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[benzyl(ethyl)amino]-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109190822
5-[benzyl(ethyl)amino]-N-(3,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109190853
5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109190820
6-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyrimidine-4-carboxamide
CID 109349422
6-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)-2-methylpyrimidine-4-carboxamide
CID 109370613
5-(diethylamino)-N-phenylpyridine-2-carboxamide
CID 109194733
5-[benzyl(ethyl)amino]-N-(3-chloro-4-methylphenyl)pyrazine-2-carboxamide
CID 109282885
5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide
CID 109182187
5-[benzyl(methyl)amino]-N-(3,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109281209
5-[benzyl(ethyl)amino]-N-butan-2-ylpyridine-2-carboxamide
CID 109181423
5-[benzyl(ethyl)amino]-N-(3-chloro-4-methylphenyl)pyridine-3-carboxamide
CID 109234873
methyl 2-[[5-[benzyl(ethyl)amino]pyridine-2-carbonyl]amino]benzoate
CID 109190861

Frequently Asked Questions

What is the IUPAC name of 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide (CID 109190828) is 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide is CCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccc(C)c(C)c2)nc1.
What is the InChIKey of 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is MXCKMNDINOKIAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-4-26(16-19-8-6-5-7-9-19)21-12-13-22(24-15-21)23(27)25-20-11-10-17(2)18(3)14-20/h5-15H,4,16H2,1-3H3,(H,25,27).
What are the key properties of 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide?
5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 4.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109190828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).