N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide

C19H22N2O6S — CID 6485568

IUPACN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)COc1ccccc1
InChIInChI=1S/C19H22N2O6S/c1-25-18-8-7-16(28(23,24)21-9-11-26-12-10-21)13-17(18)20-19(22)14-27-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,20,22)
InChIKeyZWNTVGSDPHSDEX-UHFFFAOYSA-N
MW406.46 g/mol
LogP1.73
Rot. Bonds7

About N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide

N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide (PubChem CID 6485568) has the molecular formula C19H22N2O6S and a molecular weight of 406.46 g/mol. Its IUPAC name is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide
PubChem CID6485568
Molecular FormulaC19H22N2O6S
Molecular Weight406.46 g/mol
Exact Mass406.12
IUPAC NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)COc1ccccc1
InChIInChI=1S/C19H22N2O6S/c1-25-18-8-7-16(28(23,24)21-9-11-26-12-10-21)13-17(18)20-19(22)14-27-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,20,22)
InChIKeyZWNTVGSDPHSDEX-UHFFFAOYSA-N
XLogP1.73
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.46
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(Morpholine-4-sulfonyl)-2-phenoxyaniline
CID 3809457
N4-Acetyl-N1-(2-methoxyphenyl)sulfanilamide
CID 668310
N-(3-iodophenyl)-4-methoxy-3-piperazin-1-ylbenzenesulfonamide
CID 17940215
N-benzyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
CID 4916033
3-oxo-N-(2-phenylethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
CID 4916035
N,7-dimethyl-3-oxo-N-phenyl-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
CID 5295635
4-(2,3-dihydro-4H-1,4-benzoxazin-4-ylsulfonyl)phenyl methyl ether
CID 1473035
5-Amino-N-(2-methoxy-phenyl)-2-piperidin-1-yl-benzenesulfonamide
CID 2947325
3-amino-4-ethoxy-N,N-diethylbenzene-1-sulfonamide
CID 3790387
6-(1-Piperidinylsulfonyl)-2H-1,4-benzoxazin-3(4H)-one
CID 4172058
6-(Pyrrolidine-1-sulfonyl)-4H-benzo[1,4]oxazin-3-one
CID 4916037
2-(4-Ethoxyphenoxy)-5-(morpholinosulfonyl)aniline
CID 3833553

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide?
The IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide (CID 6485568) is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide?
The canonical SMILES for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide is COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)COc1ccccc1.
What is the InChIKey of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide?
The InChIKey is ZWNTVGSDPHSDEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O6S/c1-25-18-8-7-16(28(23,24)21-9-11-26-12-10-21)13-17(18)20-19(22)14-27-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,20,22).
What are the key properties of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide?
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide has a molecular weight of 406.46 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-phenoxyacetamide is sourced from PubChem (CID 6485568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).