2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide

C12H20N2O2S2 — CID 42893989

IUPAC2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide
SMILESCC(NS(=O)(=O)N1CCCCC1C)c1cccs1
InChIInChI=1S/C12H20N2O2S2/c1-10-6-3-4-8-14(10)18(15,16)13-11(2)12-7-5-9-17-12/h5,7,9-11,13H,3-4,6,8H2,1-2H3
InChIKeyGZUYMSWVIMKZBJ-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.52
Rot. Bonds4

About 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide

2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide (PubChem CID 42893989) has the molecular formula C12H20N2O2S2 and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide
PubChem CID42893989
Molecular FormulaC12H20N2O2S2
Molecular Weight288.44 g/mol
Exact Mass288.10
IUPAC Name2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide
SMILESCC(NS(=O)(=O)N1CCCCC1C)c1cccs1
InChIInChI=1S/C12H20N2O2S2/c1-10-6-3-4-8-14(10)18(15,16)13-11(2)12-7-5-9-17-12/h5,7,9-11,13H,3-4,6,8H2,1-2H3
InChIKeyGZUYMSWVIMKZBJ-UHFFFAOYSA-N
XLogP2.52
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide?
The IUPAC name of 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide (CID 42893989) is 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide.
What is the SMILES notation for 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide?
The canonical SMILES for 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide is CC(NS(=O)(=O)N1CCCCC1C)c1cccs1.
What is the InChIKey of 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide?
The InChIKey is GZUYMSWVIMKZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S2/c1-10-6-3-4-8-14(10)18(15,16)13-11(2)12-7-5-9-17-12/h5,7,9-11,13H,3-4,6,8H2,1-2H3.
What are the key properties of 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide?
2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide has a molecular weight of 288.44 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-sulfonamide is sourced from PubChem (CID 42893989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).