Meglumine

C₇H₁₇NO₅ — CID 8567

About Meglumine

Meglumine (PubChem CID 8567) has the molecular formula C₇H₁₇NO₅ and a molecular weight of 195.21 g/mol. Its IUPAC name is (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol.

Molecular Properties

• Compound Name: Meglumine
• PubChem CID: 8567
• Molecular Formula: C₇H₁₇NO₅
• Molecular Weight: 195.21 g/mol
• Exact Mass: 195.11
• IUPAC Name: (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
• SMILES: CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
• InChI: InChI=1S/C7H17NO5/c1-8-2-4(10)6(12)7(13)5(11)3-9/h4-13H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1
• InChIKey: MBBZMMPHUWSWHV-BDVNFPICSA-N
• XLogP: -3.36
• TPSA: 113.18 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 13
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	195.21
LogP ≤ 5	-3.36
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of Meglumine?

The IUPAC name of Meglumine (CID 8567) is (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol.

What is the SMILES notation for Meglumine?

The canonical SMILES for Meglumine is CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.

What is the InChIKey of Meglumine?

The InChIKey is MBBZMMPHUWSWHV-BDVNFPICSA-N. The full InChI is InChI=1S/C7H17NO5/c1-8-2-4(10)6(12)7(13)5(11)3-9/h4-13H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1.

What are the key properties of Meglumine?

Meglumine has a molecular weight of 195.21 g/mol, XLogP of -3.36, 6 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Meglumine is sourced from PubChem (CID 8567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 8567 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 5194 — approved-drug record (CC BY-SA 4.0)

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