N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide

C16H20N2O4S2 — CID 17421204

IUPACN-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccsc2)c1
InChIInChI=1S/C16H20N2O4S2/c1-3-18(4-2)24(21,22)13-5-6-15(19)14(10-13)17-16(20)9-12-7-8-23-11-12/h5-8,10-11,19H,3-4,9H2,1-2H3,(H,17,20)
InChIKeyZNDTXZIKEQABIX-UHFFFAOYSA-N
MW368.48 g/mol
LogP2.67
Rot. Bonds7

About N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide

N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide (PubChem CID 17421204) has the molecular formula C16H20N2O4S2 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide
PubChem CID17421204
Molecular FormulaC16H20N2O4S2
Molecular Weight368.48 g/mol
Exact Mass368.09
IUPAC NameN-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccsc2)c1
InChIInChI=1S/C16H20N2O4S2/c1-3-18(4-2)24(21,22)13-5-6-15(19)14(10-13)17-16(20)9-12-7-8-23-11-12/h5-8,10-11,19H,3-4,9H2,1-2H3,(H,17,20)
InChIKeyZNDTXZIKEQABIX-UHFFFAOYSA-N
XLogP2.67
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-chloro-5-(diethylsulfamoyl)phenyl]-3-thiophen-3-ylpropanamide
CID 55370603
N-[5-[(3-chlorophenyl)sulfamoyl]-2-hydroxyphenyl]-2-thiophen-3-ylacetamide
CID 24673045
N-[2-[5-(diethylsulfamoyl)-2-hydroxyanilino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 35995593
2-[(4-chlorophenyl)methylsulfanyl]-N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]acetamide
CID 55464247
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-3-(furan-2-yl)propanamide
CID 17393633
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-fluorophenoxy)acetamide
CID 3615295
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide
CID 24644751
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-4-propan-2-ylbenzamide
CID 35993040
2-(4-aminophenyl)-N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]acetamide
CID 119682102
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-(2-phenoxyethoxy)acetamide
CID 55702289
N,N-diethyl-4-(3-thiophen-3-ylpropyl)benzenesulfonamide
CID 101025089
N-(2-ethylphenyl)-2-thiophen-3-ylacetamide
CID 7750935

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide (CID 17421204) is N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide is CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccsc2)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide?
The InChIKey is ZNDTXZIKEQABIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O4S2/c1-3-18(4-2)24(21,22)13-5-6-15(19)14(10-13)17-16(20)9-12-7-8-23-11-12/h5-8,10-11,19H,3-4,9H2,1-2H3,(H,17,20).
What are the key properties of N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide?
N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide has a molecular weight of 368.48 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-2-thiophen-3-ylacetamide is sourced from PubChem (CID 17421204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).