N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide

C18H20N2O5S — CID 110372508

IUPACN-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
SMILESCCOc1ccc(NS(=O)(=O)c2ccc(N3CCOCC3=O)cc2)cc1
InChIInChI=1S/C18H20N2O5S/c1-2-25-16-7-3-14(4-8-16)19-26(22,23)17-9-5-15(6-10-17)20-11-12-24-13-18(20)21/h3-10,19H,2,11-13H2,1H3
InChIKeyQYARLZUOHPCUEX-UHFFFAOYSA-N
MW376.43 g/mol
LogP2.25
Rot. Bonds6

About N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide

N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide (PubChem CID 110372508) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
PubChem CID110372508
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC NameN-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
SMILESCCOc1ccc(NS(=O)(=O)c2ccc(N3CCOCC3=O)cc2)cc1
InChIInChI=1S/C18H20N2O5S/c1-2-25-16-7-3-14(4-8-16)19-26(22,23)17-9-5-15(6-10-17)20-11-12-24-13-18(20)21/h3-10,19H,2,11-13H2,1H3
InChIKeyQYARLZUOHPCUEX-UHFFFAOYSA-N
XLogP2.25
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[[4-(3-oxomorpholin-4-yl)phenyl]sulfamoyl]phenyl]acetamide
CID 110363646
N-[4-(3,3-dimethylmorpholin-4-yl)phenyl]-4-ethoxybenzenesulfonamide
CID 110637700
3-chloro-4-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]benzenesulfonamide
CID 110363640
N-(2-ethylphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
CID 110372480
2-oxo-N-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-dihydrobenzimidazole-5-sulfonamide
CID 110420138
N-[4-(3-oxomorpholin-4-yl)phenyl]butane-1-sulfonamide
CID 110363609
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-ethoxybenzenesulfonamide
CID 21372462
4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
CID 925010
N-(2-methylphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
CID 110372468
4-(3-oxomorpholin-4-yl)-N-pentylbenzenesulfonamide
CID 110372460
5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide
CID 110363635

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide?
The IUPAC name of N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide (CID 110372508) is N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide?
The canonical SMILES for N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide is CCOc1ccc(NS(=O)(=O)c2ccc(N3CCOCC3=O)cc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide?
The InChIKey is QYARLZUOHPCUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-2-25-16-7-3-14(4-8-16)19-26(22,23)17-9-5-15(6-10-17)20-11-12-24-13-18(20)21/h3-10,19H,2,11-13H2,1H3.
What are the key properties of N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide?
N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide has a molecular weight of 376.43 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide is sourced from PubChem (CID 110372508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).