N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide

C16H18N2O5S2 — CID 167792664

IUPACN-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C16H18N2O5S2/c19-24(20,14-6-2-1-3-7-14)17-15-8-4-5-9-16(15)25(21,22)18-10-12-23-13-11-18/h1-9,17H,10-13H2
InChIKeyAWFYTZWVYCZAMP-UHFFFAOYSA-N
MW382.46 g/mol
LogP1.51
Rot. Bonds5

About N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide

N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide (PubChem CID 167792664) has the molecular formula C16H18N2O5S2 and a molecular weight of 382.46 g/mol. Its IUPAC name is N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide
PubChem CID167792664
Molecular FormulaC16H18N2O5S2
Molecular Weight382.46 g/mol
Exact Mass382.07
IUPAC NameN-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C16H18N2O5S2/c19-24(20,14-6-2-1-3-7-14)17-15-8-4-5-9-16(15)25(21,22)18-10-12-23-13-11-18/h1-9,17H,10-13H2
InChIKeyAWFYTZWVYCZAMP-UHFFFAOYSA-N
XLogP1.51
TPSA92.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-morpholin-4-ylsulfonylphenyl)benzenesulfonamide
CID 6469836
N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)benzenesulfonamide
CID 3881300
N-(2,3-dimethylphenyl)-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 7938577
4-(benzenesulfonyl)morpholine;ethane
CID 143200179
N-[2-(difluoromethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 3904128
2-morpholin-4-ylsulfonylphenol
CID 79020270
4-(2-chlorophenyl)sulfonylmorpholine
CID 7938037
2-morpholin-4-ylsulfonylbenzenesulfonamide
CID 43342653
N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362791
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 4235954
N-benzhydryl-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 1168367
2-fluoro-N-(2-morpholin-4-ylsulfonylphenyl)benzamide
CID 90451563

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide?
The IUPAC name of N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide (CID 167792664) is N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide.
What is the SMILES notation for N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide?
The canonical SMILES for N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide?
The InChIKey is AWFYTZWVYCZAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S2/c19-24(20,14-6-2-1-3-7-14)17-15-8-4-5-9-16(15)25(21,22)18-10-12-23-13-11-18/h1-9,17H,10-13H2.
What are the key properties of N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide?
N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide has a molecular weight of 382.46 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylsulfonylphenyl)benzenesulfonamide is sourced from PubChem (CID 167792664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).