4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide

C16H17N3O3S — CID 46680409

IUPAC4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(N3CCNC3=O)cc2)cc1
InChIInChI=1S/C16H17N3O3S/c1-12-2-8-15(9-3-12)23(21,22)18-13-4-6-14(7-5-13)19-11-10-17-16(19)20/h2-9,18H,10-11H2,1H3,(H,17,20)
InChIKeyULLKFIQSJSQDPV-UHFFFAOYSA-N
MW331.40 g/mol
LogP2.33
Rot. Bonds4

About 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide

4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide (PubChem CID 46680409) has the molecular formula C16H17N3O3S and a molecular weight of 331.40 g/mol. Its IUPAC name is 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide
PubChem CID46680409
Molecular FormulaC16H17N3O3S
Molecular Weight331.40 g/mol
Exact Mass331.10
IUPAC Name4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(N3CCNC3=O)cc2)cc1
InChIInChI=1S/C16H17N3O3S/c1-12-2-8-15(9-3-12)23(21,22)18-13-4-6-14(7-5-13)19-11-10-17-16(19)20/h2-9,18H,10-11H2,1H3,(H,17,20)
InChIKeyULLKFIQSJSQDPV-UHFFFAOYSA-N
XLogP2.33
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide
CID 110873996
4-methyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide
CID 110874022
4-fluoro-3-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide
CID 110873999
N-(3-fluoro-4-methylphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 71102161
methane;1-(4-methylphenyl)imidazolidin-2-one
CID 143511114
N-(1H-inden-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 149348973
2-methyl-N-[4-(2-oxo-1,3-diazinan-1-yl)phenyl]benzenesulfonamide
CID 110666784
N-[4-(2-oxoimidazolidin-1-yl)phenyl]thiophene-2-sulfonamide
CID 60707214
N-[4-(2-oxo-1,3-diazinan-1-yl)phenyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 110666787
N-(4-methylphenyl)-4-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzenesulfonamide
CID 4994558
4-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]benzenesulfonamide
CID 18197748
1-[4-(dimethylsulfamoylamino)phenyl]-2-oxo-1,3-diazinane
CID 110666756

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide?
The IUPAC name of 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide (CID 46680409) is 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2ccc(N3CCNC3=O)cc2)cc1.
What is the InChIKey of 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide?
The InChIKey is ULLKFIQSJSQDPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3S/c1-12-2-8-15(9-3-12)23(21,22)18-13-4-6-14(7-5-13)19-11-10-17-16(19)20/h2-9,18H,10-11H2,1H3,(H,17,20).
What are the key properties of 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide?
4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide has a molecular weight of 331.40 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 46680409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).