5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide

C12H20N2O2S2 — CID 43520978

IUPAC5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)c1ccc(CCN)s1
InChIInChI=1S/C12H20N2O2S2/c1-14(10-4-2-3-5-10)18(15,16)12-7-6-11(17-12)8-9-13/h6-7,10H,2-5,8-9,13H2,1H3
InChIKeyJHCKRHLUMLPHJT-UHFFFAOYSA-N
MW288.44 g/mol
LogP1.81
Rot. Bonds5

About 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide

5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide (PubChem CID 43520978) has the molecular formula C12H20N2O2S2 and a molecular weight of 288.44 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide
PubChem CID43520978
Molecular FormulaC12H20N2O2S2
Molecular Weight288.44 g/mol
Exact Mass288.10
IUPAC Name5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)c1ccc(CCN)s1
InChIInChI=1S/C12H20N2O2S2/c1-14(10-4-2-3-5-10)18(15,16)12-7-6-11(17-12)8-9-13/h6-7,10H,2-5,8-9,13H2,1H3
InChIKeyJHCKRHLUMLPHJT-UHFFFAOYSA-N
XLogP1.81
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
The IUPAC name of 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide (CID 43520978) is 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
The canonical SMILES for 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide is CN(C1CCCC1)S(=O)(=O)c1ccc(CCN)s1.
What is the InChIKey of 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
The InChIKey is JHCKRHLUMLPHJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S2/c1-14(10-4-2-3-5-10)18(15,16)12-7-6-11(17-12)8-9-13/h6-7,10H,2-5,8-9,13H2,1H3.
What are the key properties of 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide has a molecular weight of 288.44 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N-cyclopentyl-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 43520978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).