2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide

C17H19FN2O3S — CID 1314399

IUPAC2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FN2O3S/c1-12(2)13-3-7-15(8-4-13)20-17(21)11-19-24(22,23)16-9-5-14(18)6-10-16/h3-10,12,19H,11H2,1-2H3,(H,20,21)
InChIKeyNZDHMYQDVAFQPJ-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.87
Rot. Bonds6

About 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide

2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 1314399) has the molecular formula C17H19FN2O3S and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide
PubChem CID1314399
Molecular FormulaC17H19FN2O3S
Molecular Weight350.42 g/mol
Exact Mass350.11
IUPAC Name2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FN2O3S/c1-12(2)13-3-7-15(8-4-13)20-17(21)11-19-24(22,23)16-9-5-14(18)6-10-16/h3-10,12,19H,11H2,1-2H3,(H,20,21)
InChIKeyNZDHMYQDVAFQPJ-UHFFFAOYSA-N
XLogP2.87
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide (CID 1314399) is 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is NZDHMYQDVAFQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3S/c1-12(2)13-3-7-15(8-4-13)20-17(21)11-19-24(22,23)16-9-5-14(18)6-10-16/h3-10,12,19H,11H2,1-2H3,(H,20,21).
What are the key properties of 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide?
2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 350.42 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 1314399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).