4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide

C15H21N3O3S — CID 3041013

IUPAC4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(N2CN(C3CCCCC3)CC2=O)cc1
InChIInChI=1S/C15H21N3O3S/c16-22(20,21)14-8-6-13(7-9-14)18-11-17(10-15(18)19)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H2,16,20,21)
InChIKeyLUIZATPCSQGSQG-UHFFFAOYSA-N
MW323.42 g/mol
LogP1.27
Rot. Bonds3

About 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide

4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide (PubChem CID 3041013) has the molecular formula C15H21N3O3S and a molecular weight of 323.42 g/mol. Its IUPAC name is 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide
PubChem CID3041013
Molecular FormulaC15H21N3O3S
Molecular Weight323.42 g/mol
Exact Mass323.13
IUPAC Name4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(N2CN(C3CCCCC3)CC2=O)cc1
InChIInChI=1S/C15H21N3O3S/c16-22(20,21)14-8-6-13(7-9-14)18-11-17(10-15(18)19)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H2,16,20,21)
InChIKeyLUIZATPCSQGSQG-UHFFFAOYSA-N
XLogP1.27
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide?
The IUPAC name of 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide (CID 3041013) is 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide?
The canonical SMILES for 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide is NS(=O)(=O)c1ccc(N2CN(C3CCCCC3)CC2=O)cc1.
What is the InChIKey of 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide?
The InChIKey is LUIZATPCSQGSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3S/c16-22(20,21)14-8-6-13(7-9-14)18-11-17(10-15(18)19)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H2,16,20,21).
What are the key properties of 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide?
4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide has a molecular weight of 323.42 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 3041013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).