2-methyl-1-thiophen-2-ylsulfonylpiperidine

C10H15NO2S2 — CID 3673615

IUPAC2-methyl-1-thiophen-2-ylsulfonylpiperidine
SMILESCC1CCCCN1S(=O)(=O)c1cccs1
InChIInChI=1S/C10H15NO2S2/c1-9-5-2-3-7-11(9)15(12,13)10-6-4-8-14-10/h4,6,8-9H,2-3,5,7H2,1H3
InChIKeyLCFPIRQRJTZNSE-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.31
Rot. Bonds2

About 2-methyl-1-thiophen-2-ylsulfonylpiperidine

2-methyl-1-thiophen-2-ylsulfonylpiperidine (PubChem CID 3673615) has the molecular formula C10H15NO2S2 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2-methyl-1-thiophen-2-ylsulfonylpiperidine.

Molecular Properties

Compound Name2-methyl-1-thiophen-2-ylsulfonylpiperidine
PubChem CID3673615
Molecular FormulaC10H15NO2S2
Molecular Weight245.37 g/mol
Exact Mass245.05
IUPAC Name2-methyl-1-thiophen-2-ylsulfonylpiperidine
SMILESCC1CCCCN1S(=O)(=O)c1cccs1
InChIInChI=1S/C10H15NO2S2/c1-9-5-2-3-7-11(9)15(12,13)10-6-4-8-14-10/h4,6,8-9H,2-3,5,7H2,1H3
InChIKeyLCFPIRQRJTZNSE-UHFFFAOYSA-N
XLogP2.31
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-thiophen-2-ylsulfonylpiperidine?
The IUPAC name of 2-methyl-1-thiophen-2-ylsulfonylpiperidine (CID 3673615) is 2-methyl-1-thiophen-2-ylsulfonylpiperidine.
What is the SMILES notation for 2-methyl-1-thiophen-2-ylsulfonylpiperidine?
The canonical SMILES for 2-methyl-1-thiophen-2-ylsulfonylpiperidine is CC1CCCCN1S(=O)(=O)c1cccs1.
What is the InChIKey of 2-methyl-1-thiophen-2-ylsulfonylpiperidine?
The InChIKey is LCFPIRQRJTZNSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S2/c1-9-5-2-3-7-11(9)15(12,13)10-6-4-8-14-10/h4,6,8-9H,2-3,5,7H2,1H3.
What are the key properties of 2-methyl-1-thiophen-2-ylsulfonylpiperidine?
2-methyl-1-thiophen-2-ylsulfonylpiperidine has a molecular weight of 245.37 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-thiophen-2-ylsulfonylpiperidine is sourced from PubChem (CID 3673615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).