N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide

C24H26N2O6S — CID 1314497

IUPACN-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
SMILESCOc1ccc(OC)c(NC(=O)COc2ccc(S(=O)(=O)NCCc3ccccc3)cc2)c1
InChIInChI=1S/C24H26N2O6S/c1-30-20-10-13-23(31-2)22(16-20)26-24(27)17-32-19-8-11-21(12-9-19)33(28,29)25-15-14-18-6-4-3-5-7-18/h3-13,16,25H,14-15,17H2,1-2H3,(H,26,27)
InChIKeySBCMWSFSIRUECX-UHFFFAOYSA-N
MW470.55 g/mol
LogP3.24
Rot. Bonds11

About N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide

N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide (PubChem CID 1314497) has the molecular formula C24H26N2O6S and a molecular weight of 470.55 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
PubChem CID1314497
Molecular FormulaC24H26N2O6S
Molecular Weight470.55 g/mol
Exact Mass470.15
IUPAC NameN-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
SMILESCOc1ccc(OC)c(NC(=O)COc2ccc(S(=O)(=O)NCCc3ccccc3)cc2)c1
InChIInChI=1S/C24H26N2O6S/c1-30-20-10-13-23(31-2)22(16-20)26-24(27)17-32-19-8-11-21(12-9-19)33(28,29)25-15-14-18-6-4-3-5-7-18/h3-13,16,25H,14-15,17H2,1-2H3,(H,26,27)
InChIKeySBCMWSFSIRUECX-UHFFFAOYSA-N
XLogP3.24
TPSA102.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.55
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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
2-{4-[(isopropylamino)sulfonyl]phenoxy}-N-1-naphthylacetamide
CID 1314065
N1-[3-(3-{[(4-cyanophenyl)sulfonyl]amino}propoxy)phenyl]acetamide
CID 2802630
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-methylphenoxy)acetamide
CID 3647605
N~1~-(3-methoxyphenyl)-N~2~-[(4-methoxyphenyl)sulfonyl]-N~2~-(2-phenylethyl)glycinamide
CID 1359892
7-methyl-3-oxo-N-(2-phenylethyl)-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
CID 5295643
2-[(3,4-Dimethoxy-phenyl)-(toluene-4-sulfonyl)-amino]-N-(2-ethoxy-phenyl)-acetamide
CID 1120614
N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]-3-(4-methylphenoxy)propanamide
CID 137353897
N-Cyclohexyl-2-[(2-ethoxy-phenyl)-(toluene-4-sulfonyl)-amino]-acetamide
CID 998717
2-(4-ethylphenoxy)-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide
CID 1014119
N-(2,5-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
CID 1084217

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide (CID 1314497) is N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide is COc1ccc(OC)c(NC(=O)COc2ccc(S(=O)(=O)NCCc3ccccc3)cc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
The InChIKey is SBCMWSFSIRUECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O6S/c1-30-20-10-13-23(31-2)22(16-20)26-24(27)17-32-19-8-11-21(12-9-19)33(28,29)25-15-14-18-6-4-3-5-7-18/h3-13,16,25H,14-15,17H2,1-2H3,(H,26,27).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide has a molecular weight of 470.55 g/mol, XLogP of 3.24, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 1314497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).