5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide

C12H20N2O3S2 — CID 55033280

IUPAC5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide
SMILESCOC1CCCC1NS(=O)(=O)c1ccc(CCN)s1
InChIInChI=1S/C12H20N2O3S2/c1-17-11-4-2-3-10(11)14-19(15,16)12-6-5-9(18-12)7-8-13/h5-6,10-11,14H,2-4,7-8,13H2,1H3
InChIKeyQXCFPOLPLCLCHW-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.10
Rot. Bonds6

About 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide

5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide (PubChem CID 55033280) has the molecular formula C12H20N2O3S2 and a molecular weight of 304.44 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide
PubChem CID55033280
Molecular FormulaC12H20N2O3S2
Molecular Weight304.44 g/mol
Exact Mass304.09
IUPAC Name5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide
SMILESCOC1CCCC1NS(=O)(=O)c1ccc(CCN)s1
InChIInChI=1S/C12H20N2O3S2/c1-17-11-4-2-3-10(11)14-19(15,16)12-6-5-9(18-12)7-8-13/h5-6,10-11,14H,2-4,7-8,13H2,1H3
InChIKeyQXCFPOLPLCLCHW-UHFFFAOYSA-N
XLogP1.10
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide (CID 55033280) is 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide is COC1CCCC1NS(=O)(=O)c1ccc(CCN)s1.
What is the InChIKey of 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide?
The InChIKey is QXCFPOLPLCLCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3S2/c1-17-11-4-2-3-10(11)14-19(15,16)12-6-5-9(18-12)7-8-13/h5-6,10-11,14H,2-4,7-8,13H2,1H3.
What are the key properties of 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide?
5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide has a molecular weight of 304.44 g/mol, XLogP of 1.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide is sourced from PubChem (CID 55033280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).