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

C17H19FN2O3S — CID 113093010

IUPACN-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)cc1NS(=O)(=O)c1ccc(C(C)C)cc1
InChIInChI=1S/C17H19FN2O3S/c1-11(2)13-4-7-15(8-5-13)24(22,23)20-17-10-14(18)6-9-16(17)19-12(3)21/h4-11,20H,1-3H3,(H,19,21)
InChIKeyGAJPMIRABKUYSO-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.71
Rot. Bonds5

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

N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide (PubChem CID 113093010) has the molecular formula C17H19FN2O3S and a molecular weight of 350.42 g/mol. Its IUPAC name is N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide
PubChem CID113093010
Molecular FormulaC17H19FN2O3S
Molecular Weight350.42 g/mol
Exact Mass350.11
IUPAC NameN-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)cc1NS(=O)(=O)c1ccc(C(C)C)cc1
InChIInChI=1S/C17H19FN2O3S/c1-11(2)13-4-7-15(8-5-13)24(22,23)20-17-10-14(18)6-9-16(17)19-12(3)21/h4-11,20H,1-3H3,(H,19,21)
InChIKeyGAJPMIRABKUYSO-UHFFFAOYSA-N
XLogP3.71
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-fluoro-3-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide
CID 134040610
N-[2-[(4-chloro-3-methylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
CID 113093031
N-(5-fluoro-2-pyrrolidin-1-ylphenyl)-4-propan-2-ylbenzenesulfonamide
CID 113092411
N-(4-fluoro-2-iodophenyl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 79760758
4-fluoro-N-[2-[(4-fluorophenyl)sulfonylamino]-4,5-dimethylphenyl]benzenesulfonamide;N-phenyl-4-propan-2-ylbenzenesulfonamide
CID 70138707
3-fluoro-4-[(4-propan-2-ylphenyl)sulfonylamino]benzenesulfonamide
CID 60579391
4-(1-aminoethyl)-N-(2,5-difluorophenyl)benzenesulfonamide
CID 43105533
N-[5-fluoro-2-(methanesulfonamido)phenyl]acetamide
CID 113093308
N-[2-[(2,5-dimethylphenyl)sulfonylamino]-4-fluorophenyl]acetamide
CID 113093007
4-[(2S)-butan-2-yl]-N-(5-fluoro-2-methylphenyl)benzenesulfonamide
CID 8501128
N-[5-[(2-chloro-4-fluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 7514301
N-[2-(benzenesulfonamido)-4-fluorophenyl]benzenesulfonamide
CID 70139608

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide (CID 113093010) is N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide is CC(=O)Nc1ccc(F)cc1NS(=O)(=O)c1ccc(C(C)C)cc1.
What is the InChIKey of N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is GAJPMIRABKUYSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3S/c1-11(2)13-4-7-15(8-5-13)24(22,23)20-17-10-14(18)6-9-16(17)19-12(3)21/h4-11,20H,1-3H3,(H,19,21).
What are the key properties of N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide?
N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 350.42 g/mol, XLogP of 3.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-2-[(4-propan-2-ylphenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 113093010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).