3-piperidin-1-ylthiophene-2-sulfonamide

C9H14N2O2S2 — CID 21328002

IUPAC3-piperidin-1-ylthiophene-2-sulfonamide
SMILESNS(=O)(=O)c1sccc1N1CCCCC1
InChIInChI=1S/C9H14N2O2S2/c10-15(12,13)9-8(4-7-14-9)11-5-2-1-3-6-11/h4,7H,1-3,5-6H2,(H2,10,12,13)
InChIKeyLIUXGDPKOSEDJA-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.39
Rot. Bonds2

About 3-piperidin-1-ylthiophene-2-sulfonamide

3-piperidin-1-ylthiophene-2-sulfonamide (PubChem CID 21328002) has the molecular formula C9H14N2O2S2 and a molecular weight of 246.36 g/mol. Its IUPAC name is 3-piperidin-1-ylthiophene-2-sulfonamide.

Molecular Properties

Compound Name3-piperidin-1-ylthiophene-2-sulfonamide
PubChem CID21328002
Molecular FormulaC9H14N2O2S2
Molecular Weight246.36 g/mol
Exact Mass246.05
IUPAC Name3-piperidin-1-ylthiophene-2-sulfonamide
SMILESNS(=O)(=O)c1sccc1N1CCCCC1
InChIInChI=1S/C9H14N2O2S2/c10-15(12,13)9-8(4-7-14-9)11-5-2-1-3-6-11/h4,7H,1-3,5-6H2,(H2,10,12,13)
InChIKeyLIUXGDPKOSEDJA-UHFFFAOYSA-N
XLogP1.39
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dihydro-4,4-dioxo-6-sulfamoyl-1H-thieno[2,3-b][1,4]thiazine
CID 10061571
2,3-dihydro-1H-thieno[2,3-b][1,4]thiazine-6-sulfonamide
CID 10220331
3-Piperidin-1-ylthiophene-2-sulfonamide;hydrochloride
CID 70606025
3-Piperazin-1-ylthiophene-2-sulfonyl chloride
CID 140807937
1-Thiophen-3-ylazetidine-3-sulfonamide
CID 175031536
7,7-Dioxo-5,7lambda6-dithia-1-azatricyclo[6.2.1.02,6]undeca-2(6),3-diene-4-sulfonamide
CID 10063044
3-[2-[di(propan-2-yl)amino]ethyl]-4,4-dioxo-2,3-dihydro-1H-thieno[2,3-b][1,4]thiazine-6-sulfonamide
CID 10475811
4-amino-N-(2-piperidin-1-ylethyl)thiophene-2-sulfonamide
CID 54967813
4-amino-N-(1-ethylpiperidin-4-yl)-N-methylthiophene-2-sulfonamide
CID 61298605
4-amino-N-(1-methylpiperidin-3-yl)thiophene-2-sulfonamide
CID 61298643
5-(3-Methylpiperidin-1-yl)sulfonylthiophen-3-amine
CID 61298779
5-(3-Pyrrolidin-1-ylpiperidin-1-yl)sulfonylthiophen-3-amine
CID 61299021

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylthiophene-2-sulfonamide?
The IUPAC name of 3-piperidin-1-ylthiophene-2-sulfonamide (CID 21328002) is 3-piperidin-1-ylthiophene-2-sulfonamide.
What is the SMILES notation for 3-piperidin-1-ylthiophene-2-sulfonamide?
The canonical SMILES for 3-piperidin-1-ylthiophene-2-sulfonamide is NS(=O)(=O)c1sccc1N1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylthiophene-2-sulfonamide?
The InChIKey is LIUXGDPKOSEDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S2/c10-15(12,13)9-8(4-7-14-9)11-5-2-1-3-6-11/h4,7H,1-3,5-6H2,(H2,10,12,13).
What are the key properties of 3-piperidin-1-ylthiophene-2-sulfonamide?
3-piperidin-1-ylthiophene-2-sulfonamide has a molecular weight of 246.36 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylthiophene-2-sulfonamide is sourced from PubChem (CID 21328002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).