6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide

C22H22N4O3 — CID 109164130

IUPAC6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Nc2ccc(NC(C)=O)cc2)nc1
InChIInChI=1S/C22H22N4O3/c1-3-29-20-7-5-4-6-19(20)26-22(28)16-8-13-21(23-14-16)25-18-11-9-17(10-12-18)24-15(2)27/h4-14H,3H2,1-2H3,(H,23,25)(H,24,27)(H,26,28)
InChIKeyJESYMOLBFZHEIO-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.43
Rot. Bonds7

About 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide

6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide (PubChem CID 109164130) has the molecular formula C22H22N4O3 and a molecular weight of 390.44 g/mol. Its IUPAC name is 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
PubChem CID109164130
Molecular FormulaC22H22N4O3
Molecular Weight390.44 g/mol
Exact Mass390.17
IUPAC Name6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Nc2ccc(NC(C)=O)cc2)nc1
InChIInChI=1S/C22H22N4O3/c1-3-29-20-7-5-4-6-19(20)26-22(28)16-8-13-21(23-14-16)25-18-11-9-17(10-12-18)24-15(2)27/h4-14H,3H2,1-2H3,(H,23,25)(H,24,27)(H,26,28)
InChIKeyJESYMOLBFZHEIO-UHFFFAOYSA-N
XLogP4.43
TPSA92.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-acetamidoanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164185
N-(3,4-dimethoxyphenyl)-6-(2-ethoxyanilino)pyridine-3-carboxamide
CID 109164098
2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
CID 109178114
methyl 4-[[5-[(2-ethoxyphenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109293673
6-(4-acetamidoanilino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 109163310
4-chloro-N-[5-(2-ethoxyanilino)-2-pyridinyl]benzamide
CID 113034282
ethyl 2-[[6-(4-ethylanilino)pyridine-3-carbonyl]amino]benzoate
CID 109162871
N-(2,3-dimethylphenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109162787
6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109164093
4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
CID 26243690
2-ethoxy-N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 26522658
N-[6-(4-ethoxyanilino)-3-pyridinyl]acetamide
CID 113019659

Frequently Asked Questions

What is the IUPAC name of 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide (CID 109164130) is 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide is CCOc1ccccc1NC(=O)c1ccc(Nc2ccc(NC(C)=O)cc2)nc1.
What is the InChIKey of 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
The InChIKey is JESYMOLBFZHEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O3/c1-3-29-20-7-5-4-6-19(20)26-22(28)16-8-13-21(23-14-16)25-18-11-9-17(10-12-18)24-15(2)27/h4-14H,3H2,1-2H3,(H,23,25)(H,24,27)(H,26,28).
What are the key properties of 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide?
6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide has a molecular weight of 390.44 g/mol, XLogP of 4.43, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109164130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).