N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide

C22H20N4O3 — CID 109178526

IUPACN-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccnc(Nc3ccc(C(C)=O)cc3)c2)c1
InChIInChI=1S/C22H20N4O3/c1-14(27)16-6-8-18(9-7-16)25-21-12-17(10-11-23-21)22(29)26-20-5-3-4-19(13-20)24-15(2)28/h3-13H,1-2H3,(H,23,25)(H,24,28)(H,26,29)
InChIKeyIHYUKQHQXGJQDU-UHFFFAOYSA-N
MW388.43 g/mol
LogP4.24
Rot. Bonds6

About N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide

N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide (PubChem CID 109178526) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
PubChem CID109178526
Molecular FormulaC22H20N4O3
Molecular Weight388.43 g/mol
Exact Mass388.15
IUPAC NameN-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccnc(Nc3ccc(C(C)=O)cc3)c2)c1
InChIInChI=1S/C22H20N4O3/c1-14(27)16-6-8-18(9-7-16)25-21-12-17(10-11-23-21)22(29)26-20-5-3-4-19(13-20)24-15(2)28/h3-13H,1-2H3,(H,23,25)(H,24,28)(H,26,29)
InChIKeyIHYUKQHQXGJQDU-UHFFFAOYSA-N
XLogP4.24
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 54.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
CID 109176712
2-(3-acetamidoanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178041
N-(3-acetylphenyl)-2-(4-cyanoanilino)pyridine-4-carboxamide
CID 109178483
2-(3-acetylanilino)-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 109177507
2-(4-acetamidoanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
CID 109176294
2-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-4-carboxamide
CID 109176756
2-(3-acetamidoanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109178564
2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 109177121
2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 109177005
N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide
CID 109178580
2-(3-acetamidoanilino)-N-(2-methoxyphenyl)pyridine-4-carboxamide
CID 109177884
2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
CID 109178114

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide (CID 109178526) is N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide is CC(=O)Nc1cccc(NC(=O)c2ccnc(Nc3ccc(C(C)=O)cc3)c2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide?
The InChIKey is IHYUKQHQXGJQDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O3/c1-14(27)16-6-8-18(9-7-16)25-21-12-17(10-11-23-21)22(29)26-20-5-3-4-19(13-20)24-15(2)28/h3-13H,1-2H3,(H,23,25)(H,24,28)(H,26,29).
What are the key properties of N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide?
N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide has a molecular weight of 388.43 g/mol, XLogP of 4.24, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide is sourced from PubChem (CID 109178526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).