N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide

C23H23N3O2 — CID 109220385

IUPACN-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
SMILESCCc1cccc(C)c1Nc1ccnc(C(=O)Nc2cccc(C(C)=O)c2)c1
InChIInChI=1S/C23H23N3O2/c1-4-17-8-5-7-15(2)22(17)25-20-11-12-24-21(14-20)23(28)26-19-10-6-9-18(13-19)16(3)27/h5-14H,4H2,1-3H3,(H,24,25)(H,26,28)
InChIKeyGORANQGUEDKFQP-UHFFFAOYSA-N
MW373.46 g/mol
LogP5.15
Rot. Bonds6

About N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide

N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide (PubChem CID 109220385) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
PubChem CID109220385
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
SMILESCCc1cccc(C)c1Nc1ccnc(C(=O)Nc2cccc(C(C)=O)c2)c1
InChIInChI=1S/C23H23N3O2/c1-4-17-8-5-7-15(2)22(17)25-20-11-12-24-21(14-20)23(28)26-19-10-6-9-18(13-19)16(3)27/h5-14H,4H2,1-3H3,(H,24,25)(H,26,28)
InChIKeyGORANQGUEDKFQP-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-(3-cyanophenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
CID 109220395
4-(3-acetylanilino)-N-(2-ethylphenyl)pyridine-2-carboxamide
CID 109220139
N-(3-acetylphenyl)-4-anilinopyridine-2-carboxamide
CID 109218881
N-(2-ethyl-6-methylphenyl)-4-(3-methoxyanilino)pyridine-2-carboxamide
CID 109220361
4-(3-acetylanilino)-N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 109221343
4-(3-acetylanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109220749
2-N-(3-acetylphenyl)-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092202
N-(3-acetylphenyl)-4-(butylamino)pyridine-2-carboxamide
CID 109202795
N-(3-acetylphenyl)-4-(4-tert-butylanilino)pyridine-2-carboxamide
CID 109220583
N-(3-acetylphenyl)-2-(2-ethylanilino)pyrimidine-4-carboxamide
CID 109315553
4-(3-acetylanilino)-N-[(2-chlorophenyl)methyl]pyridine-2-carboxamide
CID 109211673
methyl 2-[[2-[(2-ethyl-6-methylphenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109220370

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide (CID 109220385) is N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide is CCc1cccc(C)c1Nc1ccnc(C(=O)Nc2cccc(C(C)=O)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
The InChIKey is GORANQGUEDKFQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-4-17-8-5-7-15(2)22(17)25-20-11-12-24-21(14-20)23(28)26-19-10-6-9-18(13-19)16(3)27/h5-14H,4H2,1-3H3,(H,24,25)(H,26,28).
What are the key properties of N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-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 N-(3-acetylphenyl)-4-(2-ethyl-6-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109220385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).