2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone

C22H20N2O2 — CID 2749284

IUPAC2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone
SMILESO=C(CNc1ccccc1)c1ccc(C(=O)CNc2ccccc2)cc1
InChIInChI=1S/C22H20N2O2/c25-21(15-23-19-7-3-1-4-8-19)17-11-13-18(14-12-17)22(26)16-24-20-9-5-2-6-10-20/h1-14,23-24H,15-16H2
InChIKeyYJNAHCCKJIPNMY-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.28
Rot. Bonds8

About 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone

2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone (PubChem CID 2749284) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone.

Molecular Properties

Compound Name2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone
PubChem CID2749284
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone
SMILESO=C(CNc1ccccc1)c1ccc(C(=O)CNc2ccccc2)cc1
InChIInChI=1S/C22H20N2O2/c25-21(15-23-19-7-3-1-4-8-19)17-11-13-18(14-12-17)22(26)16-24-20-9-5-2-6-10-20/h1-14,23-24H,15-16H2
InChIKeyYJNAHCCKJIPNMY-UHFFFAOYSA-N
XLogP4.28
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-anilino-1-(4-hydroxyphenyl)ethanone
CID 11379161
2-(4-methylanilino)-1-phenylethanone
CID 4230722
1-(3-amino-4-fluorophenyl)-2-anilinoethanone
CID 82478373
2-(3-benzoylanilino)-1-(4-chlorophenyl)ethanone
CID 110823607
2-anilino-1-(3,5-dimethoxyphenyl)ethanone
CID 116555372
2-anilino-1-(2-chlorophenyl)ethanone
CID 116555252
2-anilinoacetic acid;hydrazine
CID 67393863
2-anilino-1-(2,3-dihydro-1-benzofuran-5-yl)ethanone
CID 116555381
bis(2-anilinoacetate);cadmium(2+)
CID 88771971
potassium;sodium;2-anilinoacetic acid;hydride
CID 174390322
2-(3-benzoylanilino)-1-(4-nitrophenyl)ethanone
CID 110824996
2-[3-(hydroxymethyl)anilino]-1-(4-phenoxyphenyl)ethanone
CID 67203134

Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone?
The IUPAC name of 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone (CID 2749284) is 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone.
What is the SMILES notation for 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone?
The canonical SMILES for 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone is O=C(CNc1ccccc1)c1ccc(C(=O)CNc2ccccc2)cc1.
What is the InChIKey of 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone?
The InChIKey is YJNAHCCKJIPNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c25-21(15-23-19-7-3-1-4-8-19)17-11-13-18(14-12-17)22(26)16-24-20-9-5-2-6-10-20/h1-14,23-24H,15-16H2.
What are the key properties of 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone?
2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone has a molecular weight of 344.41 g/mol, XLogP of 4.28, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-1-[4-(2-anilinoacetyl)phenyl]ethanone is sourced from PubChem (CID 2749284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).