2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide

C23H24N4O2 — CID 109178566

IUPAC2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide
SMILESCCN(C(=O)c1ccnc(Nc2cccc(NC(C)=O)c2)c1)c1cccc(C)c1
InChIInChI=1S/C23H24N4O2/c1-4-27(21-10-5-7-16(2)13-21)23(29)18-11-12-24-22(14-18)26-20-9-6-8-19(15-20)25-17(3)28/h5-15H,4H2,1-3H3,(H,24,26)(H,25,28)
InChIKeyAYPOUXQAJLPZOM-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.76
Rot. Bonds6

About 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide

2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide (PubChem CID 109178566) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide
PubChem CID109178566
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide
SMILESCCN(C(=O)c1ccnc(Nc2cccc(NC(C)=O)c2)c1)c1cccc(C)c1
InChIInChI=1S/C23H24N4O2/c1-4-27(21-10-5-7-16(2)13-21)23(29)18-11-12-24-22(14-18)26-20-9-6-8-19(15-20)25-17(3)28/h5-15H,4H2,1-3H3,(H,24,26)(H,25,28)
InChIKeyAYPOUXQAJLPZOM-UHFFFAOYSA-N
XLogP4.76
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[[4-[ethyl-(3-methylphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109178670
N-ethyl-N-(3-methylphenyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
CID 109178870
N-ethyl-2-[(2-fluorophenyl)methylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
CID 109170542
2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
CID 109176712
N-ethyl-2-[2-(4-fluorophenyl)ethylamino]-N-(3-methylphenyl)pyridine-4-carboxamide
CID 109172719
N-ethyl-5-(3-methylanilino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109290010
3-acetamido-N-ethyl-N-phenylbenzamide
CID 17221925
N-ethyl-2-(3-methylanilino)-N-(3-methylphenyl)pyrimidine-4-carboxamide
CID 109313892
2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 109009943
6-[4-(dimethylamino)anilino]-N-ethyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109164676
2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 109177121
2-(4-ethoxyanilino)-N-ethyl-N-phenylpyridine-4-carboxamide
CID 109176932

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide (CID 109178566) is 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide is CCN(C(=O)c1ccnc(Nc2cccc(NC(C)=O)c2)c1)c1cccc(C)c1.
What is the InChIKey of 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide?
The InChIKey is AYPOUXQAJLPZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-4-27(21-10-5-7-16(2)13-21)23(29)18-11-12-24-22(14-18)26-20-9-6-8-19(15-20)25-17(3)28/h5-15H,4H2,1-3H3,(H,24,26)(H,25,28).
What are the key properties of 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide?
2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.76, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidoanilino)-N-ethyl-N-(3-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109178566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).