5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide

C10H14ClN3O3S2 — CID 60894936

IUPAC5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide
SMILESO=C(CNS(=O)(=O)c1ccc(Cl)s1)N1CCNCC1
InChIInChI=1S/C10H14ClN3O3S2/c11-8-1-2-10(18-8)19(16,17)13-7-9(15)14-5-3-12-4-6-14/h1-2,12-13H,3-7H2
InChIKeyHOEIJNAOOYBGFZ-UHFFFAOYSA-N
MW323.83 g/mol
LogP0.11
Rot. Bonds4

About 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide

5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide (PubChem CID 60894936) has the molecular formula C10H14ClN3O3S2 and a molecular weight of 323.83 g/mol. Its IUPAC name is 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide
PubChem CID60894936
Molecular FormulaC10H14ClN3O3S2
Molecular Weight323.83 g/mol
Exact Mass323.02
IUPAC Name5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide
SMILESO=C(CNS(=O)(=O)c1ccc(Cl)s1)N1CCNCC1
InChIInChI=1S/C10H14ClN3O3S2/c11-8-1-2-10(18-8)19(16,17)13-7-9(15)14-5-3-12-4-6-14/h1-2,12-13H,3-7H2
InChIKeyHOEIJNAOOYBGFZ-UHFFFAOYSA-N
XLogP0.11
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.83
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-chlorothiophen-2-yl)sulfonylpiperazine-1-carboxamide
CID 141150888
5-chloro-N-[2-[4-(cyclopropylmethylamino)piperidin-1-yl]-2-oxoethyl]thiophene-2-sulfonamide
CID 119624431
3,4-dichloro-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide
CID 60894571
5-chloro-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide;hydrochloride
CID 119401193
5-chloro-N-(2-methylpropyl)-N-(3-oxo-3-piperazin-1-ylpropyl)thiophene-2-sulfonamide
CID 50775946
5-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)thiophene-2-sulfonamide
CID 47139078
2,4-difluoro-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide
CID 60895838
2-(5-chlorothiophen-2-yl)-1-piperazin-1-ylethanone
CID 82130418
(2R,3R)-1-[2-[(5-chlorothiophen-2-yl)sulfonylamino]acetyl]-2-methylpiperidine-3-carboxylic acid
CID 122115765
5-bromo-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]thiophene-2-sulfonamide
CID 110407051
1-methyl-N-(2-oxo-2-piperazin-1-ylethyl)pyrrole-3-sulfonamide
CID 60894937
2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)pyrazole-3-sulfonamide
CID 104710214

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide (CID 60894936) is 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide is O=C(CNS(=O)(=O)c1ccc(Cl)s1)N1CCNCC1.
What is the InChIKey of 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide?
The InChIKey is HOEIJNAOOYBGFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O3S2/c11-8-1-2-10(18-8)19(16,17)13-7-9(15)14-5-3-12-4-6-14/h1-2,12-13H,3-7H2.
What are the key properties of 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide?
5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide has a molecular weight of 323.83 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-oxo-2-piperazin-1-ylethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 60894936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).