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

C22H20N4O3 — CID 109200332

IUPAC5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide
SMILESCC(=O)Nc1cccc(Nc2ccc(C(=O)Nc3cccc(C(C)=O)c3)nc2)c1
InChIInChI=1S/C22H20N4O3/c1-14(27)16-5-3-6-17(11-16)26-22(29)21-10-9-20(13-23-21)25-19-8-4-7-18(12-19)24-15(2)28/h3-13,25H,1-2H3,(H,24,28)(H,26,29)
InChIKeyCZNZNCMVUSSNAV-UHFFFAOYSA-N
MW388.43 g/mol
LogP4.24
Rot. Bonds6

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

5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide (PubChem CID 109200332) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide
PubChem CID109200332
Molecular FormulaC22H20N4O3
Molecular Weight388.43 g/mol
Exact Mass388.15
IUPAC Name5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide
SMILESCC(=O)Nc1cccc(Nc2ccc(C(=O)Nc3cccc(C(C)=O)c3)nc2)c1
InChIInChI=1S/C22H20N4O3/c1-14(27)16-5-3-6-17(11-16)26-22(29)21-10-9-20(13-23-21)25-19-8-4-7-18(12-19)24-15(2)28/h3-13,25H,1-2H3,(H,24,28)(H,26,29)
InChIKeyCZNZNCMVUSSNAV-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

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Related Compounds

5-(3-acetamidoanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199786
5-(3-acetylanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109198731
5-(3-acetamidoanilino)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109199474
N-(3-acetylphenyl)-5-(2-methylanilino)pyridine-2-carboxamide
CID 109197257
5-(3-acetylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183026
N-(3-acetylphenyl)-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-2-carboxamide
CID 109200351
methyl 3-[[6-(phenylcarbamoyl)-3-pyridinyl]amino]benzoate
CID 109197014
N-(4-acetamidophenyl)-6-(3-acetylanilino)pyridazine-3-carboxamide
CID 109129787
N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
N-(3-acetamidophenyl)-5-(2-cyanoanilino)pyridine-2-carboxamide
CID 109200420
5-(3-acetamidoanilino)-N-pentylpyridine-2-carboxamide
CID 109195775
5-(3-acetylanilino)-N-[(2-chlorophenyl)methyl]pyridine-2-carboxamide
CID 109189885

Frequently Asked Questions

What is the IUPAC name of 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide (CID 109200332) is 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide is CC(=O)Nc1cccc(Nc2ccc(C(=O)Nc3cccc(C(C)=O)c3)nc2)c1.
What is the InChIKey of 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide?
The InChIKey is CZNZNCMVUSSNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O3/c1-14(27)16-5-3-6-17(11-16)26-22(29)21-10-9-20(13-23-21)25-19-8-4-7-18(12-19)24-15(2)28/h3-13,25H,1-2H3,(H,24,28)(H,26,29).
What are the key properties of 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide?
5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-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 5-(3-acetamidoanilino)-N-(3-acetylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109200332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).