5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide

C22H22N4O3 — CID 109199969

IUPAC5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Nc2cccc(NC(C)=O)c2)cn1
InChIInChI=1S/C22H22N4O3/c1-3-29-21-10-5-4-9-19(21)26-22(28)20-12-11-18(14-23-20)25-17-8-6-7-16(13-17)24-15(2)27/h4-14,25H,3H2,1-2H3,(H,24,27)(H,26,28)
InChIKeyCXMXFNVHYONEQI-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.43
Rot. Bonds7

About 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide

5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide (PubChem CID 109199969) has the molecular formula C22H22N4O3 and a molecular weight of 390.44 g/mol. Its IUPAC name is 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
PubChem CID109199969
Molecular FormulaC22H22N4O3
Molecular Weight390.44 g/mol
Exact Mass390.17
IUPAC Name5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Nc2cccc(NC(C)=O)c2)cn1
InChIInChI=1S/C22H22N4O3/c1-3-29-21-10-5-4-9-19(21)26-22(28)20-12-11-18(14-23-20)25-17-8-6-7-16(13-17)24-15(2)27/h4-14,25H,3H2,1-2H3,(H,24,27)(H,26,28)
InChIKeyCXMXFNVHYONEQI-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

N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197177
N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109198092
5-(3-acetamidoanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199786
5-(2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109199964
5-(3-acetamidoanilino)-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109190233
5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide
CID 109200332
N-(2,6-difluorophenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109200015
5-(3-acetamidoanilino)-N-pentylpyridine-2-carboxamide
CID 109195775
N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191680
5-(3-acetamidoanilino)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109199474
2-(3-acetylanilino)-N-(2-ethoxyphenyl)-6-methylpyrimidine-4-carboxamide
CID 109337630

Frequently Asked Questions

What is the IUPAC name of 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide (CID 109199969) is 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide is CCOc1ccccc1NC(=O)c1ccc(Nc2cccc(NC(C)=O)c2)cn1.
What is the InChIKey of 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide?
The InChIKey is CXMXFNVHYONEQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O3/c1-3-29-21-10-5-4-9-19(21)26-22(28)20-12-11-18(14-23-20)25-17-8-6-7-16(13-17)24-15(2)27/h4-14,25H,3H2,1-2H3,(H,24,27)(H,26,28).
What are the key properties of 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide?
5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-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 5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109199969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).