N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride

C8H15ClN2O2S2 — CID 71756742

IUPACN-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride
SMILESCc1cc(S(=O)(=O)NCCN)c(C)s1.Cl
InChIInChI=1S/C8H14N2O2S2.ClH/c1-6-5-8(7(2)13-6)14(11,12)10-4-3-9;/h5,10H,3-4,9H2,1-2H3;1H
InChIKeyLHMHQQWDRQYUDR-UHFFFAOYSA-N
MW270.81 g/mol
LogP1.02
Rot. Bonds4

About N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride

N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride (PubChem CID 71756742) has the molecular formula C8H15ClN2O2S2 and a molecular weight of 270.81 g/mol. Its IUPAC name is N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride
PubChem CID71756742
Molecular FormulaC8H15ClN2O2S2
Molecular Weight270.81 g/mol
Exact Mass270.03
IUPAC NameN-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride
SMILESCc1cc(S(=O)(=O)NCCN)c(C)s1.Cl
InChIInChI=1S/C8H14N2O2S2.ClH/c1-6-5-8(7(2)13-6)14(11,12)10-4-3-9;/h5,10H,3-4,9H2,1-2H3;1H
InChIKeyLHMHQQWDRQYUDR-UHFFFAOYSA-N
XLogP1.02
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.81
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride (CID 71756742) is N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride is Cc1cc(S(=O)(=O)NCCN)c(C)s1.Cl.
What is the InChIKey of N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
The InChIKey is LHMHQQWDRQYUDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2S2.ClH/c1-6-5-8(7(2)13-6)14(11,12)10-4-3-9;/h5,10H,3-4,9H2,1-2H3;1H.
What are the key properties of N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride has a molecular weight of 270.81 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide;hydrochloride is sourced from PubChem (CID 71756742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).