2,5-dichloro-N-ethylthiophene-3-sulfonamide

C6H7Cl2NO2S2 — CID 2805979

IUPAC2,5-dichloro-N-ethylthiophene-3-sulfonamide
SMILESCCNS(=O)(=O)c1cc(Cl)sc1Cl
InChIInChI=1S/C6H7Cl2NO2S2/c1-2-9-13(10,11)4-3-5(7)12-6(4)8/h3,9H,2H2,1H3
InChIKeyKQDQINTXQXTLDF-UHFFFAOYSA-N
MW260.17 g/mol
LogP2.35
Rot. Bonds3

About 2,5-dichloro-N-ethylthiophene-3-sulfonamide

2,5-dichloro-N-ethylthiophene-3-sulfonamide (PubChem CID 2805979) has the molecular formula C6H7Cl2NO2S2 and a molecular weight of 260.17 g/mol. Its IUPAC name is 2,5-dichloro-N-ethylthiophene-3-sulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-ethylthiophene-3-sulfonamide
PubChem CID2805979
Molecular FormulaC6H7Cl2NO2S2
Molecular Weight260.17 g/mol
Exact Mass258.93
IUPAC Name2,5-dichloro-N-ethylthiophene-3-sulfonamide
SMILESCCNS(=O)(=O)c1cc(Cl)sc1Cl
InChIInChI=1S/C6H7Cl2NO2S2/c1-2-9-13(10,11)4-3-5(7)12-6(4)8/h3,9H,2H2,1H3
InChIKeyKQDQINTXQXTLDF-UHFFFAOYSA-N
XLogP2.35
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-(3-chloro-2-methylpropyl)thiophene-3-sulfonamide
CID 65036898
N-(3-aminopropyl)-2,5-dichlorothiophene-3-sulfonamide
CID 43167116
2,5-dichloro-N-(3-iodopropyl)thiophene-3-sulfonamide
CID 114504676
2,5-dichloro-N-[(3,5-dichlorophenyl)methyl]thiophene-3-sulfonamide
CID 3871882
N-(3-bromobutyl)-2,5-dichlorothiophene-3-sulfonamide
CID 114297747
N-benzyl-2,5-dichlorothiophene-3-sulfonamide
CID 39791947
2,5-dichloro-N-(4-hydroxy-2,2-dimethylbutyl)thiophene-3-sulfonamide
CID 113318751
N-[3-(bromomethyl)pentan-3-yl]-2,5-dichlorothiophene-3-sulfonamide
CID 113271110
2,5-dichloro-N-[2-[(2,5-dichlorothiophen-3-yl)sulfonylamino]-4,5-dimethylphenyl]thiophene-3-sulfonamide
CID 70138974
2,5-dichloro-N-(2-phenylpropyl)thiophene-3-sulfonamide
CID 55365000
N-(2-amino-4-methylpentyl)-2,5-dichlorothiophene-3-sulfonamide
CID 43606292
2,5-dichloro-N-(3-oxopentan-2-yl)thiophene-3-sulfonamide
CID 64993790

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-ethylthiophene-3-sulfonamide?
The IUPAC name of 2,5-dichloro-N-ethylthiophene-3-sulfonamide (CID 2805979) is 2,5-dichloro-N-ethylthiophene-3-sulfonamide.
What is the SMILES notation for 2,5-dichloro-N-ethylthiophene-3-sulfonamide?
The canonical SMILES for 2,5-dichloro-N-ethylthiophene-3-sulfonamide is CCNS(=O)(=O)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-ethylthiophene-3-sulfonamide?
The InChIKey is KQDQINTXQXTLDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7Cl2NO2S2/c1-2-9-13(10,11)4-3-5(7)12-6(4)8/h3,9H,2H2,1H3.
What are the key properties of 2,5-dichloro-N-ethylthiophene-3-sulfonamide?
2,5-dichloro-N-ethylthiophene-3-sulfonamide has a molecular weight of 260.17 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-ethylthiophene-3-sulfonamide is sourced from PubChem (CID 2805979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).