Furtrethonium

C₈H₁₄NO+ — CID 10938

About Furtrethonium

Furtrethonium (PubChem CID 10938) has the molecular formula C₈H₁₄NO+ and a molecular weight of 140.21 g/mol. Its IUPAC name is furan-2-ylmethyl(trimethyl)azanium.

Molecular Properties

• Compound Name: Furtrethonium
• PubChem CID: 10938
• Molecular Formula: C₈H₁₄NO+
• Molecular Weight: 140.21 g/mol
• Exact Mass: 140.11
• IUPAC Name: furan-2-ylmethyl(trimethyl)azanium
• SMILES: C[N+](C)(C)Cc1ccco1
• InChI: InChI=1S/C8H14NO/c1-9(2,3)7-8-5-4-6-10-8/h4-6H,7H2,1-3H3/q+1
• InChIKey: HEDXEAAVEOJUCR-UHFFFAOYSA-N
• XLogP: 1.49
• TPSA: 13.14 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 10
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	140.21
LogP ≤ 5	1.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Furtrethonium?

The IUPAC name of Furtrethonium (CID 10938) is furan-2-ylmethyl(trimethyl)azanium.

What is the SMILES notation for Furtrethonium?

The canonical SMILES for Furtrethonium is C[N+](C)(C)Cc1ccco1.

What is the InChIKey of Furtrethonium?

The InChIKey is HEDXEAAVEOJUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14NO/c1-9(2,3)7-8-5-4-6-10-8/h4-6H,7H2,1-3H3/q+1.

What are the key properties of Furtrethonium?

Furtrethonium has a molecular weight of 140.21 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for Furtrethonium is sourced from PubChem (CID 10938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 10938 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 3256 — approved-drug record (CC BY-SA 4.0)

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