5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide

C15H21ClN2O5S — CID 5306904

IUPAC5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide
SMILESCCCNS(=O)(=O)c1cc(Cl)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C15H21ClN2O5S/c1-2-5-17-24(20,21)14-10-12(16)3-4-13(14)23-11-15(19)18-6-8-22-9-7-18/h3-4,10,17H,2,5-9,11H2,1H3
InChIKeyVMSVIRQLTHBXDL-UHFFFAOYSA-N
MW376.86 g/mol
LogP1.27
Rot. Bonds7

About 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide

5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide (PubChem CID 5306904) has the molecular formula C15H21ClN2O5S and a molecular weight of 376.86 g/mol. Its IUPAC name is 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide.

Molecular Properties

Compound Name5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide
PubChem CID5306904
Molecular FormulaC15H21ClN2O5S
Molecular Weight376.86 g/mol
Exact Mass376.09
IUPAC Name5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide
SMILESCCCNS(=O)(=O)c1cc(Cl)ccc1OCC(=O)N1CCOCC1
InChIInChI=1S/C15H21ClN2O5S/c1-2-5-17-24(20,21)14-10-12(16)3-4-13(14)23-11-15(19)18-6-8-22-9-7-18/h3-4,10,17H,2,5-9,11H2,1H3
InChIKeyVMSVIRQLTHBXDL-UHFFFAOYSA-N
XLogP1.27
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.86
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-(2-quinolin-8-yloxyethyl)benzenesulfonamide
CID 5303366
2-(4-chloro-2-morpholin-4-ylsulfonylphenoxy)-1-(4-methylpiperazin-1-yl)ethanone
CID 30147244
1-(azepan-1-yl)-2-(4-chloro-2-morpholin-4-ylsulfonylphenoxy)ethanone
CID 30147236
2-(4-chloro-2-morpholin-4-ylsulfonylphenoxy)-1-(4-methylpiperidin-1-yl)ethanone
CID 30147219
2-[4-chloro-2-(1-hydroxyethyl)phenoxy]-1-morpholin-4-ylethanone
CID 62074602
2-[4-chloro-2-[(1S)-1-hydroxyethyl]phenoxy]-1-morpholin-4-ylethanone
CID 78931421
5-chloro-2-methoxy-N-propylbenzenesulfonamide
CID 2234484
2-[4-chloro-2-[2-(propylamino)ethylsulfamoyl]phenoxy]acetamide
CID 120716467
5-chloro-2-ethoxy-N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]benzenesulfonamide
CID 30126282
2-(4-chloro-2-morpholin-4-ylsulfonylphenoxy)-N-[(2S)-pentan-2-yl]acetamide
CID 30147306
5-fluoro-2-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide
CID 82915954
N-benzyl-3-chloro-4-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide
CID 1007908

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide?
The IUPAC name of 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide (CID 5306904) is 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide.
What is the SMILES notation for 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide?
The canonical SMILES for 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide is CCCNS(=O)(=O)c1cc(Cl)ccc1OCC(=O)N1CCOCC1.
What is the InChIKey of 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide?
The InChIKey is VMSVIRQLTHBXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O5S/c1-2-5-17-24(20,21)14-10-12(16)3-4-13(14)23-11-15(19)18-6-8-22-9-7-18/h3-4,10,17H,2,5-9,11H2,1H3.
What are the key properties of 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide?
5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide has a molecular weight of 376.86 g/mol, XLogP of 1.27, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2-morpholin-4-yl-2-oxoethoxy)-N-propylbenzenesulfonamide is sourced from PubChem (CID 5306904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).