N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide

C₁₉H₂₁FN₂O₄S — CID 155952127

About N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide

N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide (PubChem CID 155952127) has the molecular formula C₁₉H₂₁FN₂O₄S and a molecular weight of 392.45 g/mol. Its IUPAC name is N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide.

Molecular Properties

• Compound Name: N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide
• PubChem CID: 155952127
• Molecular Formula: C₁₉H₂₁FN₂O₄S
• Molecular Weight: 392.45 g/mol
• Exact Mass: 392.12
• IUPAC Name: N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide
• SMILES: CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NC(=O)Cc2cccc(F)c2)cc1
• InChI: InChI=1S/C19H21FN2O4S/c1-19(2,3)18(24)21-15-7-9-16(10-8-15)27(25,26)22-17(23)12-13-5-4-6-14(20)11-13/h4-11H,12H2,1-3H3,(H,21,24)(H,22,23)
• InChIKey: GRKJVXLAFWPVEX-UHFFFAOYSA-N
• XLogP: 2.86
• TPSA: 92.34 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	392.45
LogP ≤ 5	2.86
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide?

The IUPAC name of N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide (CID 155952127) is N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide.

What is the SMILES notation for N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide?

The canonical SMILES for N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NC(=O)Cc2cccc(F)c2)cc1.

What is the InChIKey of N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide?

The InChIKey is GRKJVXLAFWPVEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O4S/c1-19(2,3)18(24)21-15-7-9-16(10-8-15)27(25,26)22-17(23)12-13-5-4-6-14(20)11-13/h4-11H,12H2,1-3H3,(H,21,24)(H,22,23).

What are the key properties of N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide?

N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide has a molecular weight of 392.45 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[[2-(3-fluorophenyl)acetyl]sulfamoyl]phenyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 155952127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155952127 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.