5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide

C23H23N3O2 — CID 109198731

IUPAC5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
SMILESCC(=O)c1cccc(Nc2ccc(C(=O)Nc3c(C)cc(C)cc3C)nc2)c1
InChIInChI=1S/C23H23N3O2/c1-14-10-15(2)22(16(3)11-14)26-23(28)21-9-8-20(13-24-21)25-19-7-5-6-18(12-19)17(4)27/h5-13,25H,1-4H3,(H,26,28)
InChIKeyOJLFQXIIVBZZEP-UHFFFAOYSA-N
MW373.46 g/mol
LogP5.21
Rot. Bonds5

About 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide

5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide (PubChem CID 109198731) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
PubChem CID109198731
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
SMILESCC(=O)c1cccc(Nc2ccc(C(=O)Nc3c(C)cc(C)cc3C)nc2)c1
InChIInChI=1S/C23H23N3O2/c1-14-10-15(2)22(16(3)11-14)26-23(28)21-9-8-20(13-24-21)25-19-7-5-6-18(12-19)17(4)27/h5-13,25H,1-4H3,(H,26,28)
InChIKeyOJLFQXIIVBZZEP-UHFFFAOYSA-N
XLogP5.21
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.46
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide
CID 109200332
5-(3-methoxyanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109198726
4-(3-acetylanilino)-N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 109221343
N-(3-acetylphenyl)-5-(2-methylanilino)pyridine-2-carboxamide
CID 109197257
5-(3-acetylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183026
N-(3-acetylphenyl)-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-2-carboxamide
CID 109200351
1-(3-acetylphenyl)-3-(2,4,6-trimethylphenyl)urea
CID 108991665
N-[5-(3-acetylanilino)-2-pyridinyl]-3-methylbenzamide
CID 113034958
5-(3-acetylanilino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 109185048
5-(3-cyanoanilino)-N-(2,6-dimethylphenyl)pyridine-2-carboxamide
CID 109198246
5-(3-acetamidoanilino)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109199474
5-(3-acetylanilino)-N-[(2-chlorophenyl)methyl]pyridine-2-carboxamide
CID 109189885

Frequently Asked Questions

What is the IUPAC name of 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide (CID 109198731) is 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide is CC(=O)c1cccc(Nc2ccc(C(=O)Nc3c(C)cc(C)cc3C)nc2)c1.
What is the InChIKey of 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide?
The InChIKey is OJLFQXIIVBZZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-14-10-15(2)22(16(3)11-14)26-23(28)21-9-8-20(13-24-21)25-19-7-5-6-18(12-19)17(4)27/h5-13,25H,1-4H3,(H,26,28).
What are the key properties of 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide?
5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide has a molecular weight of 373.46 g/mol, XLogP of 5.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109198731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).