5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide

C8H12ClNO3S2 — CID 39369239

IUPAC5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
SMILESCCN(CCO)S(=O)(=O)c1ccc(Cl)s1
InChIInChI=1S/C8H12ClNO3S2/c1-2-10(5-6-11)15(12,13)8-4-3-7(9)14-8/h3-4,11H,2,5-6H2,1H3
InChIKeyBWRSBGDZZZRECV-UHFFFAOYSA-N
MW269.77 g/mol
LogP1.40
Rot. Bonds5

About 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide

5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide (PubChem CID 39369239) has the molecular formula C8H12ClNO3S2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
PubChem CID39369239
Molecular FormulaC8H12ClNO3S2
Molecular Weight269.77 g/mol
Exact Mass268.99
IUPAC Name5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
SMILESCCN(CCO)S(=O)(=O)c1ccc(Cl)s1
InChIInChI=1S/C8H12ClNO3S2/c1-2-10(5-6-11)15(12,13)8-4-3-7(9)14-8/h3-4,11H,2,5-6H2,1H3
InChIKeyBWRSBGDZZZRECV-UHFFFAOYSA-N
XLogP1.40
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide (CID 39369239) is 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide is CCN(CCO)S(=O)(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide?
The InChIKey is BWRSBGDZZZRECV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12ClNO3S2/c1-2-10(5-6-11)15(12,13)8-4-3-7(9)14-8/h3-4,11H,2,5-6H2,1H3.
What are the key properties of 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide?
5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide has a molecular weight of 269.77 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 39369239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).