N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide

C22H20N2O3 — CID 109009860

IUPACN-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
SMILESCC(=O)c1cccc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C22H20N2O3/c1-16(25)17-6-5-7-19(14-17)24-22(26)15-23-18-10-12-21(13-11-18)27-20-8-3-2-4-9-20/h2-14,23H,15H2,1H3,(H,24,26)
InChIKeyVGBYYUCNIVOGSJ-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.73
Rot. Bonds7

About N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide

N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide (PubChem CID 109009860) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
PubChem CID109009860
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC NameN-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
SMILESCC(=O)c1cccc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C22H20N2O3/c1-16(25)17-6-5-7-19(14-17)24-22(26)15-23-18-10-12-21(13-11-18)27-20-8-3-2-4-9-20/h2-14,23H,15H2,1H3,(H,24,26)
InChIKeyVGBYYUCNIVOGSJ-UHFFFAOYSA-N
XLogP4.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamidophenyl)-2-(4-phenoxyanilino)acetamide
CID 54812613
N-butyl-3-[[2-(4-phenoxyanilino)acetyl]amino]benzamide
CID 54812285
methyl 4-[[2-(3-acetylanilino)-2-oxoethyl]amino]benzoate
CID 26506872
N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
CID 26506544
N-(3-butan-2-yloxyphenyl)-2-(4-phenoxyanilino)acetamide
CID 54812451
methyl 3-[3-(4-phenoxyanilino)propanoylamino]benzoate
CID 109041391
2-(3-fluoroanilino)-N-(4-phenoxyphenyl)acetamide
CID 9098919
N,N-diethyl-3-[[2-[4-(2-phenoxyethoxy)anilino]acetyl]amino]benzamide
CID 54822926
N-(3-acetylphenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109009580
N-[3-[[2-(4-ethoxyanilino)acetyl]amino]phenyl]benzamide
CID 54811131
2-(3-acetylanilino)-N-isoquinolin-6-ylacetamide
CID 59857970
2-anilino-N-(3-ethoxyphenyl)acetamide
CID 54810362

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide (CID 109009860) is N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide is CC(=O)c1cccc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide?
The InChIKey is VGBYYUCNIVOGSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-16(25)17-6-5-7-19(14-17)24-22(26)15-23-18-10-12-21(13-11-18)27-20-8-3-2-4-9-20/h2-14,23H,15H2,1H3,(H,24,26).
What are the key properties of N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide?
N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide has a molecular weight of 360.41 g/mol, XLogP of 4.73, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide is sourced from PubChem (CID 109009860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).