N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide

C23H22N2O2 — CID 55726687

IUPACN-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
SMILESCCc1ccc(C(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H22N2O2/c1-2-17-13-15-19(16-14-17)22(26)25-21(18-9-5-3-6-10-18)23(27)24-20-11-7-4-8-12-20/h3-16,21H,2H2,1H3,(H,24,27)(H,25,26)
InChIKeyZOLKIMFQLLBRNU-UHFFFAOYSA-N
MW358.44 g/mol
LogP4.36
Rot. Bonds6

About N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide

N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide (PubChem CID 55726687) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
PubChem CID55726687
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC NameN-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
SMILESCCc1ccc(C(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H22N2O2/c1-2-17-13-15-19(16-14-17)22(26)25-21(18-9-5-3-6-10-18)23(27)24-20-11-7-4-8-12-20/h3-16,21H,2H2,1H3,(H,24,27)(H,25,26)
InChIKeyZOLKIMFQLLBRNU-UHFFFAOYSA-N
XLogP4.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-anilino-2-oxo-1-phenylethyl)-4-(diethylaminomethyl)benzamide
CID 55779074
N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide
CID 55726661
N-(2-anilino-2-oxo-1-phenylethyl)-4-(dimethylsulfamoyl)benzamide
CID 55779161
N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide
CID 15658553
4-fluoro-N-[(1S)-2-[4-(hydroxyamino)anilino]-2-oxo-1-phenylethyl]benzamide
CID 72705119
4-ethyl-N-[(1S)-2-hydroxy-1-phenylethyl]benzamide
CID 103945042
3-bromo-N-[(1S)-2-[4-(hydroxycarbamoyl)anilino]-2-oxo-1-phenylethyl]benzamide
CID 171346842
N-hydroxy-4-[[(2S)-2-phenyl-2-(2-propylpentanoylamino)acetyl]amino]benzamide
CID 72705315
N-(4-ethylphenyl)benzamide
CID 774063
N-(4-ethylphenyl)-2-phenylbutanamide
CID 2905197
[4-(1-phenylethylcarbamoyl)phenyl] 4-ethylbenzoate
CID 23597756
N-(3-benzamidophenyl)-4-ethylbenzamide
CID 17102471

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide?
The IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide (CID 55726687) is N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide.
What is the SMILES notation for N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide?
The canonical SMILES for N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide is CCc1ccc(C(=O)NC(C(=O)Nc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide?
The InChIKey is ZOLKIMFQLLBRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-2-17-13-15-19(16-14-17)22(26)25-21(18-9-5-3-6-10-18)23(27)24-20-11-7-4-8-12-20/h3-16,21H,2H2,1H3,(H,24,27)(H,25,26).
What are the key properties of N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide?
N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide has a molecular weight of 358.44 g/mol, XLogP of 4.36, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide is sourced from PubChem (CID 55726687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).