N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide

C18H20N2O5S — CID 110367598

IUPACN-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
SMILESCOc1ccc(N2CC(CNS(=O)(=O)c3ccccc3)OCC2=O)cc1
InChIInChI=1S/C18H20N2O5S/c1-24-15-9-7-14(8-10-15)20-12-16(25-13-18(20)21)11-19-26(22,23)17-5-3-2-4-6-17/h2-10,16,19H,11-13H2,1H3
InChIKeyKBZNVQSJBSKQDB-UHFFFAOYSA-N
MW376.43 g/mol
LogP1.41
Rot. Bonds6

About N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide

N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide (PubChem CID 110367598) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
PubChem CID110367598
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC NameN-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
SMILESCOc1ccc(N2CC(CNS(=O)(=O)c3ccccc3)OCC2=O)cc1
InChIInChI=1S/C18H20N2O5S/c1-24-15-9-7-14(8-10-15)20-12-16(25-13-18(20)21)11-19-26(22,23)17-5-3-2-4-6-17/h2-10,16,19H,11-13H2,1H3
InChIKeyKBZNVQSJBSKQDB-UHFFFAOYSA-N
XLogP1.41
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 ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
CID 110367600
N-[[4-(4-chlorophenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
CID 110367451
N-[[5-oxo-4-(4-propan-2-ylphenyl)morpholin-2-yl]methyl]benzenesulfonamide
CID 110367829
N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]propane-1-sulfonamide
CID 110367596
N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide
CID 110367685
3-acetyl-N-[(5-oxo-4-phenylmorpholin-2-yl)methyl]benzenesulfonamide
CID 110367066
N-[[4-(3,4-dimethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methylbenzenesulfonamide
CID 110367909
N-[[4-(3,5-dimethylphenyl)-5-oxomorpholin-2-yl]methyl]-4-methylbenzenesulfonamide
CID 110367989
N-[(3S)-1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]benzenesulfonamide
CID 7564660
4-methoxy-N-[[3-(3-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzenesulfonamide
CID 16922728
5-chloro-N-[(5-oxo-4-phenylmorpholin-2-yl)methyl]thiophene-2-sulfonamide
CID 110367046
2,4-dimethyl-N-[[4-(4-methylphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
CID 110367262

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide?
The IUPAC name of N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide (CID 110367598) is N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide.
What is the SMILES notation for N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide?
The canonical SMILES for N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide is COc1ccc(N2CC(CNS(=O)(=O)c3ccccc3)OCC2=O)cc1.
What is the InChIKey of N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide?
The InChIKey is KBZNVQSJBSKQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-24-15-9-7-14(8-10-15)20-12-16(25-13-18(20)21)11-19-26(22,23)17-5-3-2-4-6-17/h2-10,16,19H,11-13H2,1H3.
What are the key properties of N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide?
N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide has a molecular weight of 376.43 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide is sourced from PubChem (CID 110367598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).