5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide

C11H14N2O2S3 — CID 43520972

IUPAC5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide
SMILESNCCc1ccc(S(=O)(=O)NCc2cccs2)s1
InChIInChI=1S/C11H14N2O2S3/c12-6-5-9-3-4-11(17-9)18(14,15)13-8-10-2-1-7-16-10/h1-4,7,13H,5-6,8,12H2
InChIKeySDRZFFBMQLHETD-UHFFFAOYSA-N
MW302.45 g/mol
LogP1.79
Rot. Bonds6

About 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide

5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide (PubChem CID 43520972) has the molecular formula C11H14N2O2S3 and a molecular weight of 302.45 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide
PubChem CID43520972
Molecular FormulaC11H14N2O2S3
Molecular Weight302.45 g/mol
Exact Mass302.02
IUPAC Name5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide
SMILESNCCc1ccc(S(=O)(=O)NCc2cccs2)s1
InChIInChI=1S/C11H14N2O2S3/c12-6-5-9-3-4-11(17-9)18(14,15)13-8-10-2-1-7-16-10/h1-4,7,13H,5-6,8,12H2
InChIKeySDRZFFBMQLHETD-UHFFFAOYSA-N
XLogP1.79
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.45
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(thiophen-2-ylmethylsulfamoyl)thiophene-2-carbothioamide
CID 106270297
5-(2-aminoethyl)-N-[(2-fluorophenyl)methyl]thiophene-2-sulfonamide
CID 43520900
5-(2-aminoethyl)-N-(thiophen-3-ylmethyl)thiophene-2-sulfonamide
CID 63244126
5-(2-aminoethyl)-N-[(3-methylphenyl)methyl]thiophene-2-sulfonamide
CID 60903374
5-(2-aminoethyl)-N-phenylthiophene-2-sulfonamide
CID 43520785
5-(2-aminoethyl)-N-(2-thiophen-3-ylethyl)thiophene-2-sulfonamide
CID 61477775
5-(2-aminoethyl)-N-pyridin-4-ylthiophene-2-sulfonamide
CID 43520810
5-(2-aminoethyl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]thiophene-2-sulfonamide
CID 106049150
5-(thiophen-2-ylmethylsulfamoyl)thiophene-3-carboxylic acid
CID 43242554
5-(2-aminoethyl)-N-(2,6-dibromophenyl)thiophene-2-sulfonamide
CID 107601110
3-amino-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 4713669
5-(2-aminoethyl)-N-(3-methylsulfanylbutyl)thiophene-2-sulfonamide
CID 113494086

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide (CID 43520972) is 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide is NCCc1ccc(S(=O)(=O)NCc2cccs2)s1.
What is the InChIKey of 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is SDRZFFBMQLHETD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S3/c12-6-5-9-3-4-11(17-9)18(14,15)13-8-10-2-1-7-16-10/h1-4,7,13H,5-6,8,12H2.
What are the key properties of 5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide?
5-(2-aminoethyl)-N-(thiophen-2-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 302.45 g/mol, XLogP of 1.79, 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-(thiophen-2-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 43520972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).