N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide

C17H18N2O5S — CID 110372370

IUPACN-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc(N2CCOC2=O)cc1
InChIInChI=1S/C17H18N2O5S/c1-2-23-16-6-4-3-5-15(16)18-25(21,22)14-9-7-13(8-10-14)19-11-12-24-17(19)20/h3-10,18H,2,11-12H2,1H3
InChIKeyIFKNTYODQXONJB-UHFFFAOYSA-N
MW362.41 g/mol
LogP2.84
Rot. Bonds6

About N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide

N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide (PubChem CID 110372370) has the molecular formula C17H18N2O5S and a molecular weight of 362.41 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
PubChem CID110372370
Molecular FormulaC17H18N2O5S
Molecular Weight362.41 g/mol
Exact Mass362.09
IUPAC NameN-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc(N2CCOC2=O)cc1
InChIInChI=1S/C17H18N2O5S/c1-2-23-16-6-4-3-5-15(16)18-25(21,22)14-9-7-13(8-10-14)19-11-12-24-17(19)20/h3-10,18H,2,11-12H2,1H3
InChIKeyIFKNTYODQXONJB-UHFFFAOYSA-N
XLogP2.84
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
CID 7559506
N-(2-methoxy-5-methylphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
CID 110372372
1-(2-ethoxyphenyl)-3-[3-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]prop-2-ynyl]urea
CID 90554067
N-(2-ethoxyphenyl)-4-(4-methyl-1,1,3-trioxo-1,2-thiazolidin-2-yl)benzenesulfonamide
CID 22694695
N-(2-ethoxyphenyl)-4-hydrazinylbenzenesulfonamide
CID 43454824
4-(aminomethyl)-N-(2-ethoxyphenyl)benzenesulfonamide
CID 28546723
N-(2-ethoxyphenyl)-4-nitrobenzenesulfonamide
CID 779776
N-(2-ethylphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
CID 110372480
N-(2-ethoxyphenyl)-2-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 86848405
4-(2-chloroethyl)-N-(2-ethoxyphenyl)benzenesulfonamide
CID 56690501
N-(2-ethoxyphenyl)-3-methyl-2-oxo-1,3-benzoxazole-5-sulfonamide
CID 110760844
N-(2-ethoxyphenyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide
CID 7161405

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide?
The IUPAC name of N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide (CID 110372370) is N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide?
The canonical SMILES for N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide is CCOc1ccccc1NS(=O)(=O)c1ccc(N2CCOC2=O)cc1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide?
The InChIKey is IFKNTYODQXONJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O5S/c1-2-23-16-6-4-3-5-15(16)18-25(21,22)14-9-7-13(8-10-14)19-11-12-24-17(19)20/h3-10,18H,2,11-12H2,1H3.
What are the key properties of N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide?
N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide has a molecular weight of 362.41 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide is sourced from PubChem (CID 110372370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).