1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol

C14H29NO5 — CID 178064876

About 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol

1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol (PubChem CID 178064876) has the molecular formula C14H29NO5 and a molecular weight of 291.39 g/mol. Its IUPAC name is 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol.

Molecular Properties

• Compound Name: 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol
• PubChem CID: 178064876
• Molecular Formula: C14H29NO5
• Molecular Weight: 291.39 g/mol
• Exact Mass: 291.20
• IUPAC Name: 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol
• SMILES: CC(O)COC(CO)OCC1(C)CCCC(C)(C)N1O
• InChI: InChI=1S/C14H29NO5/c1-11(17)9-19-12(8-16)20-10-14(4)7-5-6-13(2,3)15(14)18/h11-12,16-18H,5-10H2,1-4H3
• InChIKey: UEQMKQKFXMAXOG-UHFFFAOYSA-N
• XLogP: 1.13
• TPSA: 82.39 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	291.39
LogP ≤ 5	1.13
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol?

The IUPAC name of 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol (CID 178064876) is 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol.

What is the SMILES notation for 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol?

The canonical SMILES for 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol is CC(O)COC(CO)OCC1(C)CCCC(C)(C)N1O.

What is the InChIKey of 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol?

The InChIKey is UEQMKQKFXMAXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO5/c1-11(17)9-19-12(8-16)20-10-14(4)7-5-6-13(2,3)15(14)18/h11-12,16-18H,5-10H2,1-4H3.

What are the key properties of 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol?

1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol has a molecular weight of 291.39 g/mol, XLogP of 1.13, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-hydroxy-1-[(1-hydroxy-2,6,6-trimethylpiperidin-2-yl)methoxy]ethoxy]propan-2-ol is sourced from PubChem (CID 178064876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).