5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide

C8H14N2O4S3 — CID 43134149

IUPAC5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
SMILESCCS(=O)(=O)NC(C)c1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C8H14N2O4S3/c1-3-16(11,12)10-6(2)7-4-5-8(15-7)17(9,13)14/h4-6,10H,3H2,1-2H3,(H2,9,13,14)
InChIKeyAFCWNKHSFVOEPJ-UHFFFAOYSA-N
MW298.41 g/mol
LogP0.40
Rot. Bonds5

About 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide

5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 43134149) has the molecular formula C8H14N2O4S3 and a molecular weight of 298.41 g/mol. Its IUPAC name is 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
PubChem CID43134149
Molecular FormulaC8H14N2O4S3
Molecular Weight298.41 g/mol
Exact Mass298.01
IUPAC Name5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
SMILESCCS(=O)(=O)NC(C)c1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C8H14N2O4S3/c1-3-16(11,12)10-6(2)7-4-5-8(15-7)17(9,13)14/h4-6,10H,3H2,1-2H3,(H2,9,13,14)
InChIKeyAFCWNKHSFVOEPJ-UHFFFAOYSA-N
XLogP0.40
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[1-(3,3-dimethylbutylsulfonylamino)ethyl]thiophene-2-sulfonamide
CID 103521332
5-[1-(propan-2-ylsulfonylamino)ethyl]thiophene-2-sulfonamide
CID 60862958
N-[1-(5-sulfamoylthiophen-2-yl)ethyl]butanamide
CID 43133919
5-[1-(cyclopentylsulfonylamino)ethyl]thiophene-2-sulfonamide
CID 105361263
N-[1-(5-sulfamoylthiophen-2-yl)ethyl]pyridine-3-sulfonamide
CID 43134153
3-methyl-N-[1-(5-sulfamoylthiophen-2-yl)ethyl]pentanamide
CID 114875220
2-ethoxy-N-[1-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
CID 43133916
1-methyl-N-[1-(5-sulfamoylthiophen-2-yl)ethyl]imidazole-4-sulfonamide
CID 62373470
4-iodo-N-[1-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 43246478
2-amino-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanesulfonamide
CID 61472334
1-methyl-N-[1-(5-sulfamoylthiophen-2-yl)ethyl]pyrazole-4-carboxamide
CID 43246483
5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide
CID 146570649

Frequently Asked Questions

What is the IUPAC name of 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide (CID 43134149) is 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide is CCS(=O)(=O)NC(C)c1ccc(S(N)(=O)=O)s1.
What is the InChIKey of 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is AFCWNKHSFVOEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O4S3/c1-3-16(11,12)10-6(2)7-4-5-8(15-7)17(9,13)14/h4-6,10H,3H2,1-2H3,(H2,9,13,14).
What are the key properties of 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 298.41 g/mol, XLogP of 0.40, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 43134149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).