1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)

C84H184N5O11+3 — CID 162005543

About 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)

1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol) (PubChem CID 162005543) has the molecular formula C84H184N5O11+3 and a molecular weight of 1440.42 g/mol. Its IUPAC name is 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol).

Molecular Properties

• Compound Name: 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)
• PubChem CID: 162005543
• Molecular Formula: C84H184N5O11+3
• Molecular Weight: 1440.42 g/mol
• Exact Mass: 1439.40
• IUPAC Name: 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)
• SMILES: C.C.C.C.CC1(C)CC(C)(C)CC(C)(O)C1.CC1(C)CC(C)(C)CC(C)(O)C1.CC1CC(C)(C)N(C)C(C)(C)C1.CC1CC(C)(C)[NH+](O)C(C)(C)C1.CC1CC(C)(C)[NH+](O)C(C)(C)C1.COCC(O)COC1CC(C)(C)N(C)C(C)(C)C1.COCC(O)COC1CC(C)(C)[NH+](O)C(C)(C)C1
• InChI: InChI=1S/C14H29NO3.C13H27NO4.C11H23N.2C11H22O.2C10H21NO.4CH4/c1-13(2)7-12(8-14(3,4)15(13)5)18-10-11(16)9-17-6;1-12(2)6-11(7-13(3,4)14(12)16)18-9-10(15)8-17-5;1-9-7-10(2,3)12(6)11(4,5)8-9;2*1-9(2)6-10(3,4)8-11(5,12)7-9;2*1-8-6-9(2,3)11(12)10(4,5)7-8;;;;/h11-12,16H,7-10H2,1-6H3;10-11,15-16H,6-9H2,1-5H3;9H,7-8H2,1-6H3;2*12H,6-8H2,1-5H3;2*8,12H,6-7H2,1-5H3;4*1H4/p+3
• InChIKey: IKHQGKPFVQUWHN-UHFFFAOYSA-Q
• XLogP: 15.56
• TPSA: 198.33 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 13
• Rotatable Bonds: 10
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1440.42
LogP ≤ 5	15.56
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	13

Frequently Asked Questions

What is the IUPAC name of 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)?

The IUPAC name of 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol) (CID 162005543) is 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol).

What is the SMILES notation for 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)?

The canonical SMILES for 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol) is C.C.C.C.CC1(C)CC(C)(C)CC(C)(O)C1.CC1(C)CC(C)(C)CC(C)(O)C1.CC1CC(C)(C)N(C)C(C)(C)C1.CC1CC(C)(C)[NH+](O)C(C)(C)C1.CC1CC(C)(C)[NH+](O)C(C)(C)C1.COCC(O)COC1CC(C)(C)N(C)C(C)(C)C1.COCC(O)COC1CC(C)(C)[NH+](O)C(C)(C)C1.

What is the InChIKey of 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)?

The InChIKey is IKHQGKPFVQUWHN-UHFFFAOYSA-Q. The full InChI is InChI=1S/C14H29NO3.C13H27NO4.C11H23N.2C11H22O.2C10H21NO.4CH4/c1-13(2)7-12(8-14(3,4)15(13)5)18-10-11(16)9-17-6;1-12(2)6-11(7-13(3,4)14(12)16)18-9-10(15)8-17-5;1-9-7-10(2,3)12(6)11(4,5)8-9;2*1-9(2)6-10(3,4)8-11(5,12)7-9;2*1-8-6-9(2,3)11(12)10(4,5)7-8;;;;/h11-12,16H,7-10H2,1-6H3;10-11,15-16H,6-9H2,1-5H3;9H,7-8H2,1-6H3;2*12H,6-8H2,1-5H3;2*8,12H,6-7H2,1-5H3;4*1H4/p+3.

What are the key properties of 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol)?

1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol) has a molecular weight of 1440.42 g/mol, XLogP of 15.56, 10 rotatable bonds, 10 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2,2,4,6,6-hexamethylpiperidine;bis(1-hydroxy-2,2,4,6,6-pentamethylpiperidin-1-ium);1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)oxy-3-methoxypropan-2-ol;methane;1-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypropan-2-ol;bis(1,3,3,5,5-pentamethylcyclohexan-1-ol) is sourced from PubChem (CID 162005543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).