2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide

C21H21N3O2 — CID 23632545

IUPAC2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1cccnc1Nc1c(C)cccc1C
InChIInChI=1S/C21H21N3O2/c1-14-8-6-9-15(2)19(14)24-20-16(10-7-13-22-20)21(25)23-17-11-4-5-12-18(17)26-3/h4-13H,1-3H3,(H,22,24)(H,23,25)
InChIKeyHLZYLSHDCFVLJZ-UHFFFAOYSA-N
MW347.42 g/mol
LogP4.70
Rot. Bonds5

About 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide

2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 23632545) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID23632545
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1cccnc1Nc1c(C)cccc1C
InChIInChI=1S/C21H21N3O2/c1-14-8-6-9-15(2)19(14)24-20-16(10-7-13-22-20)21(25)23-17-11-4-5-12-18(17)26-3/h4-13H,1-3H3,(H,22,24)(H,23,25)
InChIKeyHLZYLSHDCFVLJZ-UHFFFAOYSA-N
XLogP4.70
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-chloroanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 23633001
N-(4-chlorophenyl)-2-(2-methoxyanilino)pyridine-3-carboxamide
CID 23632593
N-(4-chlorophenyl)-2-(2,6-dimethylanilino)pyridine-3-carboxamide
CID 23632609
N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)pyridine-3-carboxamide
CID 23632728
2-(2-methoxyanilino)-N-propylpyridine-3-carboxamide
CID 32736796
2-(2-methylanilino)-N-phenylpyridine-3-carboxamide
CID 23632378
N-(2-bromophenyl)-2-(3-methoxyanilino)pyridine-3-carboxamide
CID 23632783
3-hydroxy-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 54860878
N'-(3-hydroxy-2-pyridinyl)-N-(2-methoxyphenyl)oxamide
CID 11087413
3-[(2-methoxybenzoyl)amino]pyridine-2-carboxylic acid
CID 104740315
N-(2,6-dimethylphenyl)-2-(3-methylanilino)pyridine-3-carboxamide
CID 23633002
2-(2-methoxyanilino)-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]pyridine-3-carboxamide
CID 56585498

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide (CID 23632545) is 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide is COc1ccccc1NC(=O)c1cccnc1Nc1c(C)cccc1C.
What is the InChIKey of 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is HLZYLSHDCFVLJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-14-8-6-9-15(2)19(14)24-20-16(10-7-13-22-20)21(25)23-17-11-4-5-12-18(17)26-3/h4-13H,1-3H3,(H,22,24)(H,23,25).
What are the key properties of 2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 4.70, 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-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 23632545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).