(2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole

C₁₀H₁₁NS — CID 167294933

About (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole

(2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole (PubChem CID 167294933) has the molecular formula C₁₀H₁₁NS and a molecular weight of 177.27 g/mol. Its IUPAC name is (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole.

Molecular Properties

• Compound Name: (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole
• PubChem CID: 167294933
• Molecular Formula: C₁₀H₁₁NS
• Molecular Weight: 177.27 g/mol
• Exact Mass: 177.06
• IUPAC Name: (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole
• SMILES: C/C=c1\c(=C/C)sc2[nH]ccc12
• InChI: InChI=1S/C10H11NS/c1-3-7-8-5-6-11-10(8)12-9(7)4-2/h3-6,11H,1-2H3/b7-3-,9-4+
• InChIKey: ZNGREOVUZRYSSA-CITSBAIRSA-N
• XLogP: 1.83
• TPSA: 15.79 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	177.27
LogP ≤ 5	1.83
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole?

The IUPAC name of (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole (CID 167294933) is (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole.

What is the SMILES notation for (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole?

The canonical SMILES for (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole is C/C=c1\c(=C/C)sc2[nH]ccc12.

What is the InChIKey of (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole?

The InChIKey is ZNGREOVUZRYSSA-CITSBAIRSA-N. The full InChI is InChI=1S/C10H11NS/c1-3-7-8-5-6-11-10(8)12-9(7)4-2/h3-6,11H,1-2H3/b7-3-,9-4+.

What are the key properties of (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole?

(2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole has a molecular weight of 177.27 g/mol, XLogP of 1.83, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for (2E,3Z)-2,3-di(ethylidene)-6H-thieno[2,3-b]pyrrole is sourced from PubChem (CID 167294933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 167294933 — identifiers, structure, computed properties (public domain)

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