N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide

C13H22N2O5S2 — CID 55364957

IUPACN-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
SMILESCOCCN(CCOC)S(=O)(=O)c1ccc(CNC(C)=O)s1
InChIInChI=1S/C13H22N2O5S2/c1-11(16)14-10-12-4-5-13(21-12)22(17,18)15(6-8-19-2)7-9-20-3/h4-5H,6-10H2,1-3H3,(H,14,16)
InChIKeyXUOZNTLTSBIHBI-UHFFFAOYSA-N
MW350.46 g/mol
LogP0.67
Rot. Bonds10

About N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide

N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide (PubChem CID 55364957) has the molecular formula C13H22N2O5S2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
PubChem CID55364957
Molecular FormulaC13H22N2O5S2
Molecular Weight350.46 g/mol
Exact Mass350.10
IUPAC NameN-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
SMILESCOCCN(CCOC)S(=O)(=O)c1ccc(CNC(C)=O)s1
InChIInChI=1S/C13H22N2O5S2/c1-11(16)14-10-12-4-5-13(21-12)22(17,18)15(6-8-19-2)7-9-20-3/h4-5H,6-10H2,1-3H3,(H,14,16)
InChIKeyXUOZNTLTSBIHBI-UHFFFAOYSA-N
XLogP0.67
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide
CID 30963365
N-[[5-(2-methoxyethylsulfamoyl)thiophen-2-yl]methyl]acetamide
CID 30180963
2-[5-[ethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 61384509
N-[[5-[(4-methoxyphenyl)methyl-methylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55353278
N-[[5-[2-(4-chlorophenoxy)ethyl-methylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 39793693
2-[5-[2-cyanoethyl(2-methoxyethyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 63285665
methyl 3-[2-methoxyethyl-(5-methylthiophen-2-yl)sulfonylamino]propanoate
CID 78959599
N-[[5-[ethyl-(4-fluorophenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55384100
N-(2-methoxyethyl)-N-prop-2-enyl-5-(propylaminomethyl)thiophene-2-sulfonamide
CID 103340653
N-[[5-[ethyl(oxolan-3-ylmethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 51097870
N-[[5-(diethylsulfamoyl)thiophen-2-yl]methyl]-N'-methylpyrrolidine-1-carboximidamide
CID 119114598
(4-methylphenyl) 5-(acetamidomethyl)thiophene-2-sulfonate
CID 39792029

Frequently Asked Questions

What is the IUPAC name of N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide (CID 55364957) is N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide is COCCN(CCOC)S(=O)(=O)c1ccc(CNC(C)=O)s1.
What is the InChIKey of N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
The InChIKey is XUOZNTLTSBIHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O5S2/c1-11(16)14-10-12-4-5-13(21-12)22(17,18)15(6-8-19-2)7-9-20-3/h4-5H,6-10H2,1-3H3,(H,14,16).
What are the key properties of N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide has a molecular weight of 350.46 g/mol, XLogP of 0.67, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide is sourced from PubChem (CID 55364957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).