2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide

C22H23N3O2 — CID 109176772

IUPAC2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccnc(Nc2c(C)cccc2C)c1
InChIInChI=1S/C22H23N3O2/c1-14-8-9-19(27-4)18(12-14)24-22(26)17-10-11-23-20(13-17)25-21-15(2)6-5-7-16(21)3/h5-13H,1-4H3,(H,23,25)(H,24,26)
InChIKeyPLTPLEBVXMCJMG-UHFFFAOYSA-N
MW361.45 g/mol
LogP5.01
Rot. Bonds5

About 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide

2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide (PubChem CID 109176772) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
PubChem CID109176772
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccnc(Nc2c(C)cccc2C)c1
InChIInChI=1S/C22H23N3O2/c1-14-8-9-19(27-4)18(12-14)24-22(26)17-10-11-23-20(13-17)25-21-15(2)6-5-7-16(21)3/h5-13H,1-4H3,(H,23,25)(H,24,26)
InChIKeyPLTPLEBVXMCJMG-UHFFFAOYSA-N
XLogP5.01
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.45
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-(2,6-dimethylphenyl)-1-N-(2-methoxy-5-methylphenyl)benzene-1,3-dicarboxamide
CID 109057247
N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109178248
N-(2-methoxy-5-methylphenyl)-2-(2,3,4-trifluoroanilino)pyridine-4-carboxamide
CID 109178240
methyl 2-[[2-(2,6-dimethylanilino)pyridine-4-carbonyl]amino]benzoate
CID 109176780
N-(2,5-dimethoxyphenyl)-2-(4-methylanilino)pyridine-4-carboxamide
CID 109176317
2-tert-butyl-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
CID 4731310
5-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109198259
N-(2,4-dimethoxyphenyl)-2-(2,5-dimethylanilino)pyridine-4-carboxamide
CID 109176642
2-[2-(3-chlorophenyl)ethylamino]-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
CID 109175999
N-(4-ethylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109176882
1-N-(2,4-dimethylphenyl)-3-N-(2-methoxy-5-methylphenyl)benzene-1,3-dicarboxamide
CID 109057155
N-(2-methoxy-5-methylphenyl)-2-(2-methyl-6-propan-2-ylanilino)pyrimidine-5-carboxamide
CID 109268180

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide (CID 109176772) is 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide is COc1ccc(C)cc1NC(=O)c1ccnc(Nc2c(C)cccc2C)c1.
What is the InChIKey of 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
The InChIKey is PLTPLEBVXMCJMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-14-8-9-19(27-4)18(12-14)24-22(26)17-10-11-23-20(13-17)25-21-15(2)6-5-7-16(21)3/h5-13H,1-4H3,(H,23,25)(H,24,26).
What are the key properties of 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide?
2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 5.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109176772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).