N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide

C19H22N2O5S — CID 110367685

IUPACN-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide
SMILESCOc1cccc(N2CC(CNS(=O)(=O)c3ccccc3C)OCC2=O)c1
InChIInChI=1S/C19H22N2O5S/c1-14-6-3-4-9-18(14)27(23,24)20-11-17-12-21(19(22)13-26-17)15-7-5-8-16(10-15)25-2/h3-10,17,20H,11-13H2,1-2H3
InChIKeyYZJSDNMCDNYWME-UHFFFAOYSA-N
MW390.46 g/mol
LogP1.71
Rot. Bonds6

About N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide

N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide (PubChem CID 110367685) has the molecular formula C19H22N2O5S and a molecular weight of 390.46 g/mol. Its IUPAC name is N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide
PubChem CID110367685
Molecular FormulaC19H22N2O5S
Molecular Weight390.46 g/mol
Exact Mass390.12
IUPAC NameN-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide
SMILESCOc1cccc(N2CC(CNS(=O)(=O)c3ccccc3C)OCC2=O)c1
InChIInChI=1S/C19H22N2O5S/c1-14-6-3-4-9-18(14)27(23,24)20-11-17-12-21(19(22)13-26-17)15-7-5-8-16(10-15)25-2/h3-10,17,20H,11-13H2,1-2H3
InChIKeyYZJSDNMCDNYWME-UHFFFAOYSA-N
XLogP1.71
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]carbamate
CID 110367661
N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
CID 110367598
2,4-dimethyl-N-[[4-(4-methylphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
CID 110367262
N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-4-methylbenzamide
CID 110367624
2-methoxy-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367630
6-(3-aminopropyl)-4-(3-methoxyphenyl)morpholin-3-one
CID 115060280
4-fluoro-N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzenesulfonamide
CID 110367600
N-[[4-(3,4-dimethylphenyl)-5-oxomorpholin-2-yl]methyl]-3-methylbenzenesulfonamide
CID 110367909
4-methoxy-N-[[3-(3-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzenesulfonamide
CID 16922728
3-chloro-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367650
N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]propane-1-sulfonamide
CID 110367596
3-acetyl-N-[(5-oxo-4-phenylmorpholin-2-yl)methyl]benzenesulfonamide
CID 110367066

Frequently Asked Questions

What is the IUPAC name of N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide?
The IUPAC name of N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide (CID 110367685) is N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide.
What is the SMILES notation for N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide?
The canonical SMILES for N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide is COc1cccc(N2CC(CNS(=O)(=O)c3ccccc3C)OCC2=O)c1.
What is the InChIKey of N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide?
The InChIKey is YZJSDNMCDNYWME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5S/c1-14-6-3-4-9-18(14)27(23,24)20-11-17-12-21(19(22)13-26-17)15-7-5-8-16(10-15)25-2/h3-10,17,20H,11-13H2,1-2H3.
What are the key properties of N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide?
N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide has a molecular weight of 390.46 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-2-methylbenzenesulfonamide is sourced from PubChem (CID 110367685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).