N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide

C13H22N2O2S2 — CID 2317337

IUPACN-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide
SMILESCC(C)(CN1CCCCC1)NS(=O)(=O)c1cccs1
InChIInChI=1S/C13H22N2O2S2/c1-13(2,11-15-8-4-3-5-9-15)14-19(16,17)12-7-6-10-18-12/h6-7,10,14H,3-5,8-9,11H2,1-2H3
InChIKeyGXTHCPDSMWAZKG-UHFFFAOYSA-N
MW302.46 g/mol
LogP2.29
Rot. Bonds5

About N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide

N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide (PubChem CID 2317337) has the molecular formula C13H22N2O2S2 and a molecular weight of 302.46 g/mol. Its IUPAC name is N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide
PubChem CID2317337
Molecular FormulaC13H22N2O2S2
Molecular Weight302.46 g/mol
Exact Mass302.11
IUPAC NameN-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide
SMILESCC(C)(CN1CCCCC1)NS(=O)(=O)c1cccs1
InChIInChI=1S/C13H22N2O2S2/c1-13(2,11-15-8-4-3-5-9-15)14-19(16,17)12-7-6-10-18-12/h6-7,10,14H,3-5,8-9,11H2,1-2H3
InChIKeyGXTHCPDSMWAZKG-UHFFFAOYSA-N
XLogP2.29
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide (CID 2317337) is N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide is CC(C)(CN1CCCCC1)NS(=O)(=O)c1cccs1.
What is the InChIKey of N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide?
The InChIKey is GXTHCPDSMWAZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2S2/c1-13(2,11-15-8-4-3-5-9-15)14-19(16,17)12-7-6-10-18-12/h6-7,10,14H,3-5,8-9,11H2,1-2H3.
What are the key properties of N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide?
N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide has a molecular weight of 302.46 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-piperidin-1-ylpropan-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 2317337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).