2-thiophen-2-ylsulfonylpiperidine

C9H13NO2S2 — CID 117036522

IUPAC2-thiophen-2-ylsulfonylpiperidine
SMILESO=S(=O)(c1cccs1)C1CCCCN1
InChIInChI=1S/C9H13NO2S2/c11-14(12,9-5-3-7-13-9)8-4-1-2-6-10-8/h3,5,7-8,10H,1-2,4,6H2
InChIKeyHKTIGCJNHSVURM-UHFFFAOYSA-N
MW231.34 g/mol
LogP1.62
Rot. Bonds2

About 2-thiophen-2-ylsulfonylpiperidine

2-thiophen-2-ylsulfonylpiperidine (PubChem CID 117036522) has the molecular formula C9H13NO2S2 and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-thiophen-2-ylsulfonylpiperidine.

Molecular Properties

Compound Name2-thiophen-2-ylsulfonylpiperidine
PubChem CID117036522
Molecular FormulaC9H13NO2S2
Molecular Weight231.34 g/mol
Exact Mass231.04
IUPAC Name2-thiophen-2-ylsulfonylpiperidine
SMILESO=S(=O)(c1cccs1)C1CCCCN1
InChIInChI=1S/C9H13NO2S2/c11-14(12,9-5-3-7-13-9)8-4-1-2-6-10-8/h3,5,7-8,10H,1-2,4,6H2
InChIKeyHKTIGCJNHSVURM-UHFFFAOYSA-N
XLogP1.62
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenyl)sulfonylpiperidine
CID 117036507
2-(4-ethylphenyl)sulfonylpiperidine
CID 117036513
2-(3,4-dimethylphenyl)sulfonylpiperidine
CID 117036510
1-piperidin-2-yl-3-thiophen-2-ylsulfonylindole
CID 10472826
(2S)-2-thiophen-2-ylpiperidine
CID 7022116
N,N-dicyclohexylthiophene-2-sulfonamide
CID 19682432
2-thiophen-2-ylsulfonylsulfonylthiophene
CID 141485126
N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide
CID 71645820
1-cyclopentyl-2-thiophen-2-ylsulfonylethanone
CID 104756093
azepan-2-yl(thiophen-2-yl)methanone
CID 116582716
N-(3-cyclopentylsulfonylphenyl)thiophene-2-sulfonamide
CID 38945179
1-[(3S,4R)-4-thiophen-2-ylsulfonylthiolan-3-yl]pyrrolidine;dihydrate
CID 142599479

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-ylsulfonylpiperidine?
The IUPAC name of 2-thiophen-2-ylsulfonylpiperidine (CID 117036522) is 2-thiophen-2-ylsulfonylpiperidine.
What is the SMILES notation for 2-thiophen-2-ylsulfonylpiperidine?
The canonical SMILES for 2-thiophen-2-ylsulfonylpiperidine is O=S(=O)(c1cccs1)C1CCCCN1.
What is the InChIKey of 2-thiophen-2-ylsulfonylpiperidine?
The InChIKey is HKTIGCJNHSVURM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2S2/c11-14(12,9-5-3-7-13-9)8-4-1-2-6-10-8/h3,5,7-8,10H,1-2,4,6H2.
What are the key properties of 2-thiophen-2-ylsulfonylpiperidine?
2-thiophen-2-ylsulfonylpiperidine has a molecular weight of 231.34 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-ylsulfonylpiperidine is sourced from PubChem (CID 117036522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).