N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide

C20H26N2O6S — CID 55702289

IUPACN-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)COCCOc2ccccc2)c1
InChIInChI=1S/C20H26N2O6S/c1-3-22(4-2)29(25,26)17-10-11-19(23)18(14-17)21-20(24)15-27-12-13-28-16-8-6-5-7-9-16/h5-11,14,23H,3-4,12-13,15H2,1-2H3,(H,21,24)
InChIKeyOIMGYPOBAQWEQU-UHFFFAOYSA-N
MW422.50 g/mol
LogP2.46
Rot. Bonds11

About N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide

N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide (PubChem CID 55702289) has the molecular formula C20H26N2O6S and a molecular weight of 422.50 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide
PubChem CID55702289
Molecular FormulaC20H26N2O6S
Molecular Weight422.50 g/mol
Exact Mass422.15
IUPAC NameN-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)COCCOc2ccccc2)c1
InChIInChI=1S/C20H26N2O6S/c1-3-22(4-2)29(25,26)17-10-11-19(23)18(14-17)21-20(24)15-27-12-13-28-16-8-6-5-7-9-16/h5-11,14,23H,3-4,12-13,15H2,1-2H3,(H,21,24)
InChIKeyOIMGYPOBAQWEQU-UHFFFAOYSA-N
XLogP2.46
TPSA105.17 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.50
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-fluorophenoxy)acetamide
CID 3615295
N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-(2-phenoxyethoxy)acetamide
CID 55752933
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-ethoxyacetamide
CID 2947470
[2-[5-(diethylsulfamoyl)-2-methylanilino]-2-oxoethyl] 2-hydroxybenzoate
CID 7484569
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide
CID 17421204
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-3-(furan-2-yl)propanamide
CID 17393633
N-[5-(diethylsulfamoyl)-2-phenoxyphenyl]-2-methylsulfanylacetamide
CID 42997357
N-[5-(diethylsulfamoyl)-2-methylphenyl]-4-(3-methylphenoxy)butanamide
CID 4794318
N-[2-[5-(diethylsulfamoyl)-2-hydroxyanilino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 35995593
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(4-ethylphenoxy)acetamide
CID 19180420
4-(4-acetyl-2-methoxyphenoxy)-N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]butanamide
CID 55791807
2-(2-chlorophenoxy)-N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]acetamide
CID 4820431

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide (CID 55702289) is N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide is CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)COCCOc2ccccc2)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide?
The InChIKey is OIMGYPOBAQWEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O6S/c1-3-22(4-2)29(25,26)17-10-11-19(23)18(14-17)21-20(24)15-27-12-13-28-16-8-6-5-7-9-16/h5-11,14,23H,3-4,12-13,15H2,1-2H3,(H,21,24).
What are the key properties of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide?
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide has a molecular weight of 422.50 g/mol, XLogP of 2.46, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide is sourced from PubChem (CID 55702289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).