Trimetazidine

C₁₄H₂₂N₂O₃ — CID 21109

About Trimetazidine

Trimetazidine (PubChem CID 21109) has the molecular formula C₁₄H₂₂N₂O₃ and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-[(2,3,4-trimethoxyphenyl)methyl]piperazine.

Molecular Properties

• Compound Name: Trimetazidine
• PubChem CID: 21109
• Molecular Formula: C₁₄H₂₂N₂O₃
• Molecular Weight: 266.34 g/mol
• Exact Mass: 266.16
• IUPAC Name: 1-[(2,3,4-trimethoxyphenyl)methyl]piperazine
• SMILES: COc1ccc(CN2CCNCC2)c(OC)c1OC
• InChI: InChI=1S/C14H22N2O3/c1-17-12-5-4-11(13(18-2)14(12)19-3)10-16-8-6-15-7-9-16/h4-5,15H,6-10H2,1-3H3
• InChIKey: UHWVSEOVJBQKBE-UHFFFAOYSA-N
• XLogP: 1.12
• TPSA: 42.96 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 19
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	266.34
LogP ≤ 5	1.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of Trimetazidine?

The IUPAC name of Trimetazidine (CID 21109) is 1-[(2,3,4-trimethoxyphenyl)methyl]piperazine.

What is the SMILES notation for Trimetazidine?

The canonical SMILES for Trimetazidine is COc1ccc(CN2CCNCC2)c(OC)c1OC.

What is the InChIKey of Trimetazidine?

The InChIKey is UHWVSEOVJBQKBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-17-12-5-4-11(13(18-2)14(12)19-3)10-16-8-6-15-7-9-16/h4-5,15H,6-10H2,1-3H3.

What are the key properties of Trimetazidine?

Trimetazidine has a molecular weight of 266.34 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for Trimetazidine is sourced from PubChem (CID 21109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 21109 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 2750 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.