2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide

C11H14N2O2S3 — CID 114141600

IUPAC2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide
SMILESCNCc1cc(S(=O)(=O)Nc2ccsc2)c(C)s1
InChIInChI=1S/C11H14N2O2S3/c1-8-11(5-10(17-8)6-12-2)18(14,15)13-9-3-4-16-7-9/h3-5,7,12-13H,6H2,1-2H3
InChIKeyVPDKKIXTJVQYAL-UHFFFAOYSA-N
MW302.45 g/mol
LogP2.64
Rot. Bonds5

About 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide

2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide (PubChem CID 114141600) has the molecular formula C11H14N2O2S3 and a molecular weight of 302.45 g/mol. Its IUPAC name is 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide.

Molecular Properties

Compound Name2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide
PubChem CID114141600
Molecular FormulaC11H14N2O2S3
Molecular Weight302.45 g/mol
Exact Mass302.02
IUPAC Name2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide
SMILESCNCc1cc(S(=O)(=O)Nc2ccsc2)c(C)s1
InChIInChI=1S/C11H14N2O2S3/c1-8-11(5-10(17-8)6-12-2)18(14,15)13-9-3-4-16-7-9/h3-5,7,12-13H,6H2,1-2H3
InChIKeyVPDKKIXTJVQYAL-UHFFFAOYSA-N
XLogP2.64
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.45
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

2-methyl-5-(methylaminomethyl)-N-(2-thiophen-3-ylethyl)thiophene-3-sulfonamide
CID 106049842
4-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-2-sulfonamide
CID 114141603
2-methyl-5-(methylaminomethyl)-N-(5-methyl-3-pyridinyl)thiophene-3-sulfonamide
CID 106087977
2-methyl-5-(methylaminomethyl)-N-(3-methyl-2-propan-2-ylbutyl)thiophene-3-sulfonamide
CID 102915780
2-methyl-5-(methylaminomethyl)-N-(2,3,3-trimethylbutyl)thiophene-3-sulfonamide
CID 83147747
5-(methylaminomethyl)-N-thiophen-3-ylfuran-2-sulfonamide
CID 106070081
N-(2-chloro-5-fluorophenyl)-2-methyl-5-(methylaminomethyl)thiophene-3-sulfonamide
CID 106088465
5-bromo-2-fluoro-3-(methylaminomethyl)-N-thiophen-3-ylbenzenesulfonamide
CID 106070077
5-(ethylaminomethyl)-2-methyl-N-(2-methyl-4-pyridinyl)thiophene-3-sulfonamide
CID 106071355
5-amino-2,3-dimethyl-N-thiophen-3-ylbenzenesulfonamide
CID 66351008
2-methyl-5-(propylaminomethyl)-N-thiophen-3-ylfuran-3-sulfonamide
CID 106070165
5-methyl-4-(methylaminomethyl)-N-thiophen-3-yl-1H-pyrazole-3-sulfonamide
CID 106069925

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide?
The IUPAC name of 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide (CID 114141600) is 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide.
What is the SMILES notation for 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide?
The canonical SMILES for 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide is CNCc1cc(S(=O)(=O)Nc2ccsc2)c(C)s1.
What is the InChIKey of 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide?
The InChIKey is VPDKKIXTJVQYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2S3/c1-8-11(5-10(17-8)6-12-2)18(14,15)13-9-3-4-16-7-9/h3-5,7,12-13H,6H2,1-2H3.
What are the key properties of 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide?
2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide has a molecular weight of 302.45 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(methylaminomethyl)-N-thiophen-3-ylthiophene-3-sulfonamide is sourced from PubChem (CID 114141600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).