4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide

C17H18N2O4S — CID 110720566

IUPAC4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(C3CNC(=O)O3)cc2)cc1
InChIInChI=1S/C17H18N2O4S/c1-2-12-3-9-15(10-4-12)24(21,22)19-14-7-5-13(6-8-14)16-11-18-17(20)23-16/h3-10,16,19H,2,11H2,1H3,(H,18,20)
InChIKeyJQXMRXLHVSBSQD-UHFFFAOYSA-N
MW346.41 g/mol
LogP2.83
Rot. Bonds5

About 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide

4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide (PubChem CID 110720566) has the molecular formula C17H18N2O4S and a molecular weight of 346.41 g/mol. Its IUPAC name is 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide
PubChem CID110720566
Molecular FormulaC17H18N2O4S
Molecular Weight346.41 g/mol
Exact Mass346.10
IUPAC Name4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(C3CNC(=O)O3)cc2)cc1
InChIInChI=1S/C17H18N2O4S/c1-2-12-3-9-15(10-4-12)24(21,22)19-14-7-5-13(6-8-14)16-11-18-17(20)23-16/h3-10,16,19H,2,11H2,1H3,(H,18,20)
InChIKeyJQXMRXLHVSBSQD-UHFFFAOYSA-N
XLogP2.83
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-(4-iodophenyl)benzenesulfonamide
CID 1305687
2,5-dimethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide
CID 110720565
trans-(1R,2R)-2-[4-[(4-ethylphenyl)sulfonylamino]phenyl]cyclopropane-1-carboxylic acid
CID 136584796
N-(4-ethylphenyl)-4-propylbenzenesulfonamide
CID 22773839
4-ethyl-N-[4-[4-[(4-ethylphenyl)sulfonylamino]phenoxy]phenyl]benzenesulfonamide
CID 25047818
4-(2-chloroethyl)-N-(4-ethylphenyl)benzenesulfonamide
CID 28719478
N-[4-[(4-ethylphenyl)sulfamoyl]phenyl]acetamide
CID 798958
4-ethyl-N-(4-nitrophenyl)benzenesulfonamide
CID 22774107
methyl 4-[(4-ethylphenyl)sulfamoyl]benzoate
CID 26487109
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethylbenzenesulfonamide
CID 7516335
N-(4-ethylphenyl)-4-(trifluoromethoxy)benzenesulfonamide
CID 17154312
4-ethyl-N-[4-(pyridin-2-ylmethylamino)phenyl]benzenesulfonamide
CID 112982965

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide?
The IUPAC name of 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide (CID 110720566) is 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(C3CNC(=O)O3)cc2)cc1.
What is the InChIKey of 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide?
The InChIKey is JQXMRXLHVSBSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4S/c1-2-12-3-9-15(10-4-12)24(21,22)19-14-7-5-13(6-8-14)16-11-18-17(20)23-16/h3-10,16,19H,2,11H2,1H3,(H,18,20).
What are the key properties of 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide?
4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide has a molecular weight of 346.41 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[4-(2-oxo-1,3-oxazolidin-5-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 110720566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).