N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide

C8H8N2O3S3 — CID 14700205

IUPACN-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide
SMILESCNC(=O)c1cc2cc(S(N)(=O)=O)sc2s1
InChIInChI=1S/C8H8N2O3S3/c1-10-7(11)5-2-4-3-6(16(9,12)13)15-8(4)14-5/h2-3H,1H3,(H,10,11)(H2,9,12,13)
InChIKeyIHBZCQONFWJWQX-UHFFFAOYSA-N
MW276.36 g/mol
LogP0.97
Rot. Bonds2

About N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide

N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide (PubChem CID 14700205) has the molecular formula C8H8N2O3S3 and a molecular weight of 276.36 g/mol. Its IUPAC name is N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide
PubChem CID14700205
Molecular FormulaC8H8N2O3S3
Molecular Weight276.36 g/mol
Exact Mass275.97
IUPAC NameN-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide
SMILESCNC(=O)c1cc2cc(S(N)(=O)=O)sc2s1
InChIInChI=1S/C8H8N2O3S3/c1-10-7(11)5-2-4-3-6(16(9,12)13)15-8(4)14-5/h2-3H,1H3,(H,10,11)(H2,9,12,13)
InChIKeyIHBZCQONFWJWQX-UHFFFAOYSA-N
XLogP0.97
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
The IUPAC name of N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide (CID 14700205) is N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide.
What is the SMILES notation for N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
The canonical SMILES for N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide is CNC(=O)c1cc2cc(S(N)(=O)=O)sc2s1.
What is the InChIKey of N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
The InChIKey is IHBZCQONFWJWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O3S3/c1-10-7(11)5-2-4-3-6(16(9,12)13)15-8(4)14-5/h2-3H,1H3,(H,10,11)(H2,9,12,13).
What are the key properties of N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide?
N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-sulfamoylthieno[2,3-b]thiophene-2-carboxamide is sourced from PubChem (CID 14700205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).