1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol

C23H46N2O4 — CID 18728784

IUPAC1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1CC(C)(C)N(OCC(C)(O)CON2C(C)(C)CC(O)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C23H46N2O4/c1-17-11-19(2,3)24(20(4,5)12-17)28-15-23(10,27)16-29-25-21(6,7)13-18(26)14-22(25,8)9/h17-18,26-27H,11-16H2,1-10H3
InChIKeyXZTDRTGUYALNCH-UHFFFAOYSA-N
MW414.63 g/mol
LogP3.90
Rot. Bonds6

About 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol

1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 18728784) has the molecular formula C23H46N2O4 and a molecular weight of 414.63 g/mol. Its IUPAC name is 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Name1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID18728784
Molecular FormulaC23H46N2O4
Molecular Weight414.63 g/mol
Exact Mass414.35
IUPAC Name1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1CC(C)(C)N(OCC(C)(O)CON2C(C)(C)CC(O)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C23H46N2O4/c1-17-11-19(2,3)24(20(4,5)12-17)28-15-23(10,27)16-29-25-21(6,7)13-18(26)14-22(25,8)9/h17-18,26-27H,11-16H2,1-10H3
InChIKeyXZTDRTGUYALNCH-UHFFFAOYSA-N
XLogP3.90
TPSA65.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.63
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol (CID 18728784) is 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol is CC1CC(C)(C)N(OCC(C)(O)CON2C(C)(C)CC(O)CC2(C)C)C(C)(C)C1.
What is the InChIKey of 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is XZTDRTGUYALNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H46N2O4/c1-17-11-19(2,3)24(20(4,5)12-17)28-15-23(10,27)16-29-25-21(6,7)13-18(26)14-22(25,8)9/h17-18,26-27H,11-16H2,1-10H3.
What are the key properties of 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol?
1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 414.63 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxy-2-methyl-3-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 18728784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).