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

C8H14N2O4S3 — CID 43134135

IUPAC5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
SMILESCCS(=O)(=O)NCCc1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C8H14N2O4S3/c1-2-16(11,12)10-6-5-7-3-4-8(15-7)17(9,13)14/h3-4,10H,2,5-6H2,1H3,(H2,9,13,14)
InChIKeyZULWJLOZZQTASG-UHFFFAOYSA-N
MW298.41 g/mol
LogP-0.12
Rot. Bonds6

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

5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 43134135) has the molecular formula C8H14N2O4S3 and a molecular weight of 298.41 g/mol. Its IUPAC name is 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
PubChem CID43134135
Molecular FormulaC8H14N2O4S3
Molecular Weight298.41 g/mol
Exact Mass298.01
IUPAC Name5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
SMILESCCS(=O)(=O)NCCc1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C8H14N2O4S3/c1-2-16(11,12)10-6-5-7-3-4-8(15-7)17(9,13)14/h3-4,10H,2,5-6H2,1H3,(H2,9,13,14)
InChIKeyZULWJLOZZQTASG-UHFFFAOYSA-N
XLogP-0.12
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide (CID 43134135) is 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide is CCS(=O)(=O)NCCc1ccc(S(N)(=O)=O)s1.
What is the InChIKey of 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is ZULWJLOZZQTASG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O4S3/c1-2-16(11,12)10-6-5-7-3-4-8(15-7)17(9,13)14/h3-4,10H,2,5-6H2,1H3,(H2,9,13,14).
What are the key properties of 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide?
5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 298.41 g/mol, XLogP of -0.12, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 43134135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).