5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide

C22H23N3O — CID 109190820

IUPAC5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccccc2C)nc1
InChIInChI=1S/C22H23N3O/c1-3-25(16-18-10-5-4-6-11-18)19-13-14-21(23-15-19)22(26)24-20-12-8-7-9-17(20)2/h4-15H,3,16H2,1-2H3,(H,24,26)
InChIKeySMGBSEBWLMLVIU-UHFFFAOYSA-N
MW345.45 g/mol
LogP4.67
Rot. Bonds6

About 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide

5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide (PubChem CID 109190820) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide
PubChem CID109190820
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccccc2C)nc1
InChIInChI=1S/C22H23N3O/c1-3-25(16-18-10-5-4-6-11-18)19-13-14-21(23-15-19)22(26)24-20-12-8-7-9-17(20)2/h4-15H,3,16H2,1-2H3,(H,24,26)
InChIKeySMGBSEBWLMLVIU-UHFFFAOYSA-N
XLogP4.67
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[[5-[benzyl(ethyl)amino]pyridine-2-carbonyl]amino]benzoate
CID 109190861
5-[benzyl(ethyl)amino]-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109190822
5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
CID 109190828
5-[benzyl(ethyl)amino]-N-butan-2-ylpyridine-2-carboxamide
CID 109181423
5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide
CID 109182187
5-[benzyl(ethyl)amino]-N-(3,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109190853
5-(diethylamino)-N-phenylpyridine-2-carboxamide
CID 109194733
6-[benzyl(ethyl)amino]-N-(2,3-dimethylphenyl)pyrimidine-4-carboxamide
CID 109349425
N-(4-chloro-2-methylphenyl)-5-(diethylamino)pyridine-2-carboxamide
CID 109194764
5-(diethylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109194754
4-[benzyl(ethyl)amino]-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109212623
5-(ethylamino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 104640059

Frequently Asked Questions

What is the IUPAC name of 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide (CID 109190820) is 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide is CCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccccc2C)nc1.
What is the InChIKey of 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide?
The InChIKey is SMGBSEBWLMLVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O/c1-3-25(16-18-10-5-4-6-11-18)19-13-14-21(23-15-19)22(26)24-20-12-8-7-9-17(20)2/h4-15H,3,16H2,1-2H3,(H,24,26).
What are the key properties of 5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide?
5-[benzyl(ethyl)amino]-N-(2-methylphenyl)pyridine-2-carboxamide has a molecular weight of 345.45 g/mol, XLogP of 4.67, 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-(2-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109190820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).