N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide

C22H23N3O2 — CID 109163087

IUPACN-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3c(C)cc(C)cc3C)nc2)c1
InChIInChI=1S/C22H23N3O2/c1-14-10-15(2)21(16(3)11-14)25-20-9-8-17(13-23-20)22(26)24-18-6-5-7-19(12-18)27-4/h5-13H,1-4H3,(H,23,25)(H,24,26)
InChIKeyGMOXQKPIWWEOFX-UHFFFAOYSA-N
MW361.45 g/mol
LogP5.01
Rot. Bonds5

About N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide

N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide (PubChem CID 109163087) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide
PubChem CID109163087
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3c(C)cc(C)cc3C)nc2)c1
InChIInChI=1S/C22H23N3O2/c1-14-10-15(2)21(16(3)11-14)25-20-9-8-17(13-23-20)22(26)24-18-6-5-7-19(12-18)27-4/h5-13H,1-4H3,(H,23,25)(H,24,26)
InChIKeyGMOXQKPIWWEOFX-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

6-(3-bromoanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109163992
6-(3,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109163977
6-(4-chloro-2-methoxy-5-methylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109164004
methyl 2-[[5-[(3-methoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109163985
N-(2-ethyl-6-methylphenyl)-6-(3-methoxyanilino)pyridine-3-carboxamide
CID 109162989
2-N,5-N-bis(3-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1368781
N-(3-methoxyphenyl)-6-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109157277
6-(2-chloro-4,6-dimethylanilino)-N-(3-methoxyphenyl)pyrimidine-4-carboxamide
CID 109358578
3-fluoro-N-[6-(2,4,6-trimethylanilino)-3-pyridinyl]benzamide
CID 113017898
N-[6-(2,6-difluoroanilino)-3-pyridinyl]-3-methoxybenzamide
CID 113023123
N-cyclopentyl-6-(3-methoxyanilino)pyridine-3-carboxamide
CID 1447829
N-(3-acetamidophenyl)-6-(3,5-dimethylanilino)pyridine-3-carboxamide
CID 109162684

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide (CID 109163087) is N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide is COc1cccc(NC(=O)c2ccc(Nc3c(C)cc(C)cc3C)nc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide?
The InChIKey is GMOXQKPIWWEOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-14-10-15(2)21(16(3)11-14)25-20-9-8-17(13-23-20)22(26)24-18-6-5-7-19(12-18)27-4/h5-13H,1-4H3,(H,23,25)(H,24,26).
What are the key properties of N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide?
N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-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 N-(3-methoxyphenyl)-6-(2,4,6-trimethylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109163087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).