N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide

C22H23N3O2 — CID 109198225

IUPACN-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)Nc3c(C)cccc3C)nc2)cc1
InChIInChI=1S/C22H23N3O2/c1-4-27-19-11-8-17(9-12-19)24-18-10-13-20(23-14-18)22(26)25-21-15(2)6-5-7-16(21)3/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyPJSAOPRWEYPLDI-UHFFFAOYSA-N
MW361.45 g/mol
LogP5.09
Rot. Bonds6

About N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide

N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide (PubChem CID 109198225) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide
PubChem CID109198225
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)Nc3c(C)cccc3C)nc2)cc1
InChIInChI=1S/C22H23N3O2/c1-4-27-19-11-8-17(9-12-19)24-18-10-13-20(23-14-18)22(26)25-21-15(2)6-5-7-16(21)3/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyPJSAOPRWEYPLDI-UHFFFAOYSA-N
XLogP5.09
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.45
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,6-dimethylphenyl)-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109198223
N-(2-ethyl-6-methylphenyl)-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109198585
N-(2,6-dimethylphenyl)-6-(4-ethoxyanilino)pyrimidine-4-carboxamide
CID 109357133
5-(2-ethyl-6-methylanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109198604
5-(4-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181136
5-(3-cyanoanilino)-N-(2,6-dimethylphenyl)pyridine-2-carboxamide
CID 109198246
N-(2,6-dimethylphenyl)-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-2-carboxamide
CID 109198250
N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109182282
N-(4-ethoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639683
N-cyclohexyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109183016
5-(3,4-difluoroanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109200045
N-[(2-chlorophenyl)methyl]-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109189878

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide (CID 109198225) is N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide is CCOc1ccc(Nc2ccc(C(=O)Nc3c(C)cccc3C)nc2)cc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide?
The InChIKey is PJSAOPRWEYPLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-4-27-19-11-8-17(9-12-19)24-18-10-13-20(23-14-18)22(26)25-21-15(2)6-5-7-16(21)3/h5-14,24H,4H2,1-3H3,(H,25,26).
What are the key properties of N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide?
N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 5.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-5-(4-ethoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109198225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).