N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide

C11H15N3O3S3 — CID 14700203

IUPACN-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc2cc(S(N)(=O)=O)sc2s1
InChIInChI=1S/C11H15N3O3S3/c1-14(2)4-3-13-10(15)8-5-7-6-9(20(12,16)17)19-11(7)18-8/h5-6H,3-4H2,1-2H3,(H,13,15)(H2,12,16,17)
InChIKeyVMZDSUHQMLUIEF-UHFFFAOYSA-N
MW333.46 g/mol
LogP0.90
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide

N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide (PubChem CID 14700203) has the molecular formula C11H15N3O3S3 and a molecular weight of 333.46 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide
PubChem CID14700203
Molecular FormulaC11H15N3O3S3
Molecular Weight333.46 g/mol
Exact Mass333.03
IUPAC NameN-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc2cc(S(N)(=O)=O)sc2s1
InChIInChI=1S/C11H15N3O3S3/c1-14(2)4-3-13-10(15)8-5-7-6-9(20(12,16)17)19-11(7)18-8/h5-6H,3-4H2,1-2H3,(H,13,15)(H2,12,16,17)
InChIKeyVMZDSUHQMLUIEF-UHFFFAOYSA-N
XLogP0.90
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.46
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide 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-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide (CID 14700203) is N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide is CN(C)CCNC(=O)c1cc2cc(S(N)(=O)=O)sc2s1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
The InChIKey is VMZDSUHQMLUIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3S3/c1-14(2)4-3-13-10(15)8-5-7-6-9(20(12,16)17)19-11(7)18-8/h5-6H,3-4H2,1-2H3,(H,13,15)(H2,12,16,17).
What are the key properties of N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide has a molecular weight of 333.46 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide is sourced from PubChem (CID 14700203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).