thieno[3,2-b]thiophene-5-carboxamide

C7H5NOS2 — CID 2739790

IUPACthieno[3,2-b]thiophene-5-carboxamide
SMILESNC(=O)c1cc2sccc2s1
InChIInChI=1S/C7H5NOS2/c8-7(9)6-3-5-4(11-6)1-2-10-5/h1-3H,(H2,8,9)
InChIKeySNLYGXQULJJLMR-UHFFFAOYSA-N
MW183.26 g/mol
LogP2.06
Rot. Bonds1

About thieno[3,2-b]thiophene-5-carboxamide

thieno[3,2-b]thiophene-5-carboxamide (PubChem CID 2739790) has the molecular formula C7H5NOS2 and a molecular weight of 183.26 g/mol. Its IUPAC name is thieno[3,2-b]thiophene-5-carboxamide.

Molecular Properties

Compound Namethieno[3,2-b]thiophene-5-carboxamide
PubChem CID2739790
Molecular FormulaC7H5NOS2
Molecular Weight183.26 g/mol
Exact Mass182.98
IUPAC Namethieno[3,2-b]thiophene-5-carboxamide
SMILESNC(=O)c1cc2sccc2s1
InChIInChI=1S/C7H5NOS2/c8-7(9)6-3-5-4(11-6)1-2-10-5/h1-3H,(H2,8,9)
InChIKeySNLYGXQULJJLMR-UHFFFAOYSA-N
XLogP2.06
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.26
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of thieno[3,2-b]thiophene-5-carboxamide?
The IUPAC name of thieno[3,2-b]thiophene-5-carboxamide (CID 2739790) is thieno[3,2-b]thiophene-5-carboxamide.
What is the SMILES notation for thieno[3,2-b]thiophene-5-carboxamide?
The canonical SMILES for thieno[3,2-b]thiophene-5-carboxamide is NC(=O)c1cc2sccc2s1.
What is the InChIKey of thieno[3,2-b]thiophene-5-carboxamide?
The InChIKey is SNLYGXQULJJLMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NOS2/c8-7(9)6-3-5-4(11-6)1-2-10-5/h1-3H,(H2,8,9).
What are the key properties of thieno[3,2-b]thiophene-5-carboxamide?
thieno[3,2-b]thiophene-5-carboxamide has a molecular weight of 183.26 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[3,2-b]thiophene-5-carboxamide is sourced from PubChem (CID 2739790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).