N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

C23H27FN4O5S — CID 16614144

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)NC(CC)(c3ccc(F)cc3)C2=O)cc1
InChIInChI=1S/C23H27FN4O5S/c1-4-23(16-7-9-17(24)10-8-16)21(30)28(22(31)26-23)15-20(29)25-18-11-13-19(14-12-18)34(32,33)27(5-2)6-3/h7-14H,4-6,15H2,1-3H3,(H,25,29)(H,26,31)
InChIKeyKRRSXYUCHAVMRL-UHFFFAOYSA-N
MW490.56 g/mol
LogP2.65
Rot. Bonds9

About N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 16614144) has the molecular formula C23H27FN4O5S and a molecular weight of 490.56 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID16614144
Molecular FormulaC23H27FN4O5S
Molecular Weight490.56 g/mol
Exact Mass490.17
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)NC(CC)(c3ccc(F)cc3)C2=O)cc1
InChIInChI=1S/C23H27FN4O5S/c1-4-23(16-7-9-17(24)10-8-16)21(30)28(22(31)26-23)15-20(29)25-18-11-13-19(14-12-18)34(32,33)27(5-2)6-3/h7-14H,4-6,15H2,1-3H3,(H,25,29)(H,26,31)
InChIKeyKRRSXYUCHAVMRL-UHFFFAOYSA-N
XLogP2.65
TPSA115.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.56
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-[4-(diethylsulfamoyl)phenyl]-2-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7916612
2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]-N-(4-iodophenyl)acetamide
CID 4804766
N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 40814427
N-[2-chloro-5-[ethyl(phenyl)sulfamoyl]phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 3902938
N-[4-(diethylsulfamoyl)phenyl]-2-[(4R)-6-fluoro-1,1,2',5'-tetraoxospiro[2,3-dihydrothiochromene-4,4'-imidazolidine]-1'-yl]acetamide
CID 97353814
N-[4-(diethylsulfamoyl)phenyl]-2-[(4S)-6-fluoro-1,1,2',5'-tetraoxospiro[2,3-dihydrothiochromene-4,4'-imidazolidine]-1'-yl]acetamide
CID 97353813
N,N-diethyl-3-[[2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]benzamide
CID 46443985
2-[4-(4-chlorophenyl)-4-ethyl-2,5-dioxoimidazolidin-1-yl]-N-(3,4-difluorophenyl)acetamide
CID 42964377
2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 2082745
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 3263041
N-(4-acetamidophenyl)-2-[4-ethyl-4-(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 17390593
N,N-diethyl-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 4804739

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide (CID 16614144) is N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2C(=O)NC(CC)(c3ccc(F)cc3)C2=O)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is KRRSXYUCHAVMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27FN4O5S/c1-4-23(16-7-9-17(24)10-8-16)21(30)28(22(31)26-23)15-20(29)25-18-11-13-19(14-12-18)34(32,33)27(5-2)6-3/h7-14H,4-6,15H2,1-3H3,(H,25,29)(H,26,31).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 490.56 g/mol, XLogP of 2.65, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 16614144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).