2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide

C23H23N3O2 — CID 109177005

IUPAC2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccnc(Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C23H23N3O2/c1-4-17-7-5-6-15(2)22(17)26-23(28)19-12-13-24-21(14-19)25-20-10-8-18(9-11-20)16(3)27/h5-14H,4H2,1-3H3,(H,24,25)(H,26,28)
InChIKeyVLMIDBXFOFBWMT-UHFFFAOYSA-N
MW373.46 g/mol
LogP5.15
Rot. Bonds6

About 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide

2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide (PubChem CID 109177005) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
PubChem CID109177005
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccnc(Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C23H23N3O2/c1-4-17-7-5-6-15(2)22(17)26-23(28)19-12-13-24-21(14-19)25-20-10-8-18(9-11-20)16(3)27/h5-14H,4H2,1-3H3,(H,24,25)(H,26,28)
InChIKeyVLMIDBXFOFBWMT-UHFFFAOYSA-N
XLogP5.15
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.46
LogP ≤ 55.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109176999
2-(ethylamino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 62184923
1-[4-[[6-(2-ethyl-6-methylanilino)pyrimidin-4-yl]amino]phenyl]ethanone
CID 112865488
N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
CID 109178526
2-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-4-carboxamide
CID 109176756
1-[4-[[4-(2-ethyl-6-methylanilino)pyrimidin-2-yl]amino]phenyl]ethanone
CID 112903028
2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)-6-methylpyrimidine-4-carboxamide
CID 109336478
6-(4-acetamidoanilino)-N-(2-ethyl-6-methylphenyl)pyrimidine-4-carboxamide
CID 109357545
2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
CID 109178114
2-(2-ethyl-6-methylanilino)-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 109166794
2-(4-acetylanilino)-N-(2,6-diethylphenyl)pyrimidine-4-carboxamide
CID 109316275
N-(2,6-dimethylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62165900

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide (CID 109177005) is 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide is CCc1cccc(C)c1NC(=O)c1ccnc(Nc2ccc(C(C)=O)cc2)c1.
What is the InChIKey of 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
The InChIKey is VLMIDBXFOFBWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-4-17-7-5-6-15(2)22(17)26-23(28)19-12-13-24-21(14-19)25-20-10-8-18(9-11-20)16(3)27/h5-14H,4H2,1-3H3,(H,24,25)(H,26,28).
What are the key properties of 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide has a molecular weight of 373.46 g/mol, XLogP of 5.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109177005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).