N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide

C20H30N4O5S — CID 55304406

IUPACN-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)CN2C(=O)NC(C)(CC(C)C)C2=O)c1
InChIInChI=1S/C20H30N4O5S/c1-6-23(7-2)30(28,29)16-10-8-9-15(11-16)21-17(25)13-24-18(26)20(5,12-14(3)4)22-19(24)27/h8-11,14H,6-7,12-13H2,1-5H3,(H,21,25)(H,22,27)
InChIKeyXEEFXCFINBKUEG-UHFFFAOYSA-N
MW438.55 g/mol
LogP2.01
Rot. Bonds9

About N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide

N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 55304406) has the molecular formula C20H30N4O5S and a molecular weight of 438.55 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID55304406
Molecular FormulaC20H30N4O5S
Molecular Weight438.55 g/mol
Exact Mass438.19
IUPAC NameN-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)CN2C(=O)NC(C)(CC(C)C)C2=O)c1
InChIInChI=1S/C20H30N4O5S/c1-6-23(7-2)30(28,29)16-10-8-9-15(11-16)21-17(25)13-24-18(26)20(5,12-14(3)4)22-19(24)27/h8-11,14H,6-7,12-13H2,1-5H3,(H,21,25)(H,22,27)
InChIKeyXEEFXCFINBKUEG-UHFFFAOYSA-N
XLogP2.01
TPSA115.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 52.01
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

2-[(4R)-4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 41144468
N-(3-methoxyphenyl)-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 4306751
N-[3-(diethylsulfamoyl)phenyl]-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 3899374
N-[4-(diethylsulfamoyl)phenyl]-2-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7916612
N-(3-cyanophenyl)-2-[(4R)-4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2081777
2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-(4-methylphenyl)acetamide
CID 5002767
N-(3-fluoro-4-methylphenyl)-2-[(4R)-4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2430195
2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-(2-methylphenyl)acetamide
CID 51138861
N-(2,3-dichlorophenyl)-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 4790490
N-[3-(dimethylsulfamoyl)phenyl]-2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)acetamide
CID 24658435
N-[4-(difluoromethoxy)phenyl]-2-[(4R)-4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2436781
N-(3-methoxyphenyl)-2-[(4R)-4-methyl-4-(3-methylbutyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2510293

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide (CID 55304406) is N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)CN2C(=O)NC(C)(CC(C)C)C2=O)c1.
What is the InChIKey of N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is XEEFXCFINBKUEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O5S/c1-6-23(7-2)30(28,29)16-10-8-9-15(11-16)21-17(25)13-24-18(26)20(5,12-14(3)4)22-19(24)27/h8-11,14H,6-7,12-13H2,1-5H3,(H,21,25)(H,22,27).
What are the key properties of N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide?
N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 438.55 g/mol, XLogP of 2.01, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)phenyl]-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 55304406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).