N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide

C22H20N4O3 — CID 164524580

IUPACN-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cc(-c3ccc(C(C)=O)cc3)cnc2N)cc1
InChIInChI=1S/C22H20N4O3/c1-13(27)15-3-5-16(6-4-15)17-11-20(21(23)24-12-17)22(29)26-19-9-7-18(8-10-19)25-14(2)28/h3-12H,1-2H3,(H2,23,24)(H,25,28)(H,26,29)
InChIKeyIMWDBIFAHGRJOZ-UHFFFAOYSA-N
MW388.43 g/mol
LogP3.74
Rot. Bonds5

About N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide

N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide (PubChem CID 164524580) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide
PubChem CID164524580
Molecular FormulaC22H20N4O3
Molecular Weight388.43 g/mol
Exact Mass388.15
IUPAC NameN-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cc(-c3ccc(C(C)=O)cc3)cnc2N)cc1
InChIInChI=1S/C22H20N4O3/c1-13(27)15-3-5-16(6-4-15)17-11-20(21(23)24-12-17)22(29)26-19-9-7-18(8-10-19)25-14(2)28/h3-12H,1-2H3,(H2,23,24)(H,25,28)(H,26,29)
InChIKeyIMWDBIFAHGRJOZ-UHFFFAOYSA-N
XLogP3.74
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 53.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]benzoate
CID 71061208
2-amino-5-[4-[bis(2-hydroxyethyl)carbamoyl]phenyl]-N-pyridin-4-ylpyridine-3-carboxamide
CID 71061213
[4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]phenyl] formate
CID 174791748
tert-butyl N-[4-[4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]phenyl]-4-oxobutyl]carbamate
CID 159902780
methyl 4-[6-amino-5-(pyridin-4-ylcarbamoyl)-3-pyridinyl]-2-fluorobenzoate
CID 71060843
6-(4-acetylphenyl)-3-amino-N-phenylpyrazine-2-carboxamide
CID 59472127
methyl 4-[[2-amino-5-[3,5-dimethyl-4-(4-methylpiperazin-1-yl)phenyl]pyridine-3-carbonyl]amino]benzoate
CID 155777473
N-(4-acetamidophenyl)-6-aminopyridine-3-carboxamide
CID 110861506
N-(4-acetylphenyl)-5-amino-2-chlorobenzamide
CID 28723012
N-(4-acetamidophenyl)-2-(4-acetylanilino)pyrimidine-5-carboxamide
CID 109270119
N-(4-acetylphenyl)acetamide;fluoromethane
CID 160517938
N-(4-acetylphenyl)-4-aminopyridine-2-carboxamide
CID 82299178

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide (CID 164524580) is N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide is CC(=O)Nc1ccc(NC(=O)c2cc(-c3ccc(C(C)=O)cc3)cnc2N)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide?
The InChIKey is IMWDBIFAHGRJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O3/c1-13(27)15-3-5-16(6-4-15)17-11-20(21(23)24-12-17)22(29)26-19-9-7-18(8-10-19)25-14(2)28/h3-12H,1-2H3,(H2,23,24)(H,25,28)(H,26,29).
What are the key properties of N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide?
N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide has a molecular weight of 388.43 g/mol, XLogP of 3.74, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-5-(4-acetylphenyl)-2-aminopyridine-3-carboxamide is sourced from PubChem (CID 164524580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).