2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide

C22H21N3O3 — CID 109178114

IUPAC2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccnc(Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C22H21N3O3/c1-3-28-20-7-5-4-6-19(20)25-22(27)17-12-13-23-21(14-17)24-18-10-8-16(9-11-18)15(2)26/h4-14H,3H2,1-2H3,(H,23,24)(H,25,27)
InChIKeyAVOSYCZVCVVOJA-UHFFFAOYSA-N
MW375.43 g/mol
LogP4.68
Rot. Bonds7

About 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide

2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide (PubChem CID 109178114) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
PubChem CID109178114
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccnc(Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C22H21N3O3/c1-3-28-20-7-5-4-6-19(20)25-22(27)17-12-13-23-21(14-17)24-18-10-8-16(9-11-18)15(2)26/h4-14H,3H2,1-2H3,(H,23,24)(H,25,27)
InChIKeyAVOSYCZVCVVOJA-UHFFFAOYSA-N
XLogP4.68
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyphenyl)-2-(2-fluoroanilino)pyridine-4-carboxamide
CID 109177245
2-(2-cyanoanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
CID 109178127
6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109164130
N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
CID 109178526
N-(4-acetylphenyl)-2-(2-propan-2-ylanilino)pyridine-4-carboxamide
CID 109177061
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
2-(3-acetamidoanilino)-N-(2-methoxyphenyl)pyridine-4-carboxamide
CID 109177884
ethyl 4-[(2-anilinopyridine-4-carbonyl)amino]benzoate
CID 109176152
methyl 2-[[2-(4-ethylanilino)pyridine-4-carbonyl]amino]benzoate
CID 109176912
methyl 4-[[4-[(2-propan-2-ylphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109177046
2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 109177005
N-(4-acetylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955673

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide (CID 109178114) is 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide is CCOc1ccccc1NC(=O)c1ccnc(Nc2ccc(C(C)=O)cc2)c1.
What is the InChIKey of 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide?
The InChIKey is AVOSYCZVCVVOJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-3-28-20-7-5-4-6-19(20)25-22(27)17-12-13-23-21(14-17)24-18-10-8-16(9-11-18)15(2)26/h4-14H,3H2,1-2H3,(H,23,24)(H,25,27).
What are the key properties of 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide?
2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 4.68, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109178114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).