2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide

C17H19FN2O3S — CID 21148291

IUPAC2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CNS(=O)(=O)Cc1ccccc1F)c1ccccc1
InChIInChI=1S/C17H19FN2O3S/c1-13(14-7-3-2-4-8-14)20-17(21)11-19-24(22,23)12-15-9-5-6-10-16(15)18/h2-10,13,19H,11-12H2,1H3,(H,20,21)
InChIKeyIWURFEAFAIDNLF-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.12
Rot. Bonds7

About 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide

2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide (PubChem CID 21148291) has the molecular formula C17H19FN2O3S and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide
PubChem CID21148291
Molecular FormulaC17H19FN2O3S
Molecular Weight350.42 g/mol
Exact Mass350.11
IUPAC Name2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CNS(=O)(=O)Cc1ccccc1F)c1ccccc1
InChIInChI=1S/C17H19FN2O3S/c1-13(14-7-3-2-4-8-14)20-17(21)11-19-24(22,23)12-15-9-5-6-10-16(15)18/h2-10,13,19H,11-12H2,1H3,(H,20,21)
InChIKeyIWURFEAFAIDNLF-UHFFFAOYSA-N
XLogP2.12
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chlorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide
CID 21156472
N-[2-(2-fluorophenyl)ethyl]-N'-(1-phenylethyl)propanediamide
CID 108945881
2-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(1-phenylethyl)acetamide
CID 112992360
1-(2-fluorophenyl)-N-[(1R)-1-(4-fluorophenyl)ethyl]methanesulfonamide
CID 93487236
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 7733439
2-(2-chloro-6-fluorophenyl)-N-[(1R)-1-phenylethyl]acetamide
CID 839132
1-(2-fluorophenyl)-N-[(1R)-1-(4-methylphenyl)ethyl]methanesulfonamide
CID 93487203
1-(2-fluorophenyl)-N-[(2S)-3-hydroxy-2-methylpropyl]methanesulfonamide
CID 97087544
N-[(2-fluorophenyl)methyl]-2-(1-phenylethylamino)acetamide
CID 78695034
N-[(1R)-1-phenylethyl]-2-[[(1R)-1-phenylethyl]amino]acetamide
CID 7046108
2-fluoro-N-(1-phenylethyl)acetamide
CID 10329953
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(1-phenylethyl)acetamide
CID 113164165

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide (CID 21148291) is 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide is CC(NC(=O)CNS(=O)(=O)Cc1ccccc1F)c1ccccc1.
What is the InChIKey of 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide?
The InChIKey is IWURFEAFAIDNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3S/c1-13(14-7-3-2-4-8-14)20-17(21)11-19-24(22,23)12-15-9-5-6-10-16(15)18/h2-10,13,19H,11-12H2,1H3,(H,20,21).
What are the key properties of 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide?
2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide has a molecular weight of 350.42 g/mol, XLogP of 2.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methylsulfonylamino]-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 21148291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).