2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine

C20H40N2O — CID 21182099

IUPAC2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine
SMILESCC1CC(C)(C)N(ON2C(C)(C)CC(C)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C20H40N2O/c1-15-11-17(3,4)21(18(5,6)12-15)23-22-19(7,8)13-16(2)14-20(22,9)10/h15-16H,11-14H2,1-10H3
InChIKeyGTZIRGRXHUPURB-UHFFFAOYSA-N
MW324.55 g/mol
LogP5.41
Rot. Bonds2

About 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine

2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine (PubChem CID 21182099) has the molecular formula C20H40N2O and a molecular weight of 324.55 g/mol. Its IUPAC name is 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine.

Molecular Properties

Compound Name2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine
PubChem CID21182099
Molecular FormulaC20H40N2O
Molecular Weight324.55 g/mol
Exact Mass324.31
IUPAC Name2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine
SMILESCC1CC(C)(C)N(ON2C(C)(C)CC(C)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C20H40N2O/c1-15-11-17(3,4)21(18(5,6)12-15)23-22-19(7,8)13-16(2)14-20(22,9)10/h15-16H,11-14H2,1-10H3
InChIKeyGTZIRGRXHUPURB-UHFFFAOYSA-N
XLogP5.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.55
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine?
The IUPAC name of 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine (CID 21182099) is 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine.
What is the SMILES notation for 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine?
The canonical SMILES for 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine is CC1CC(C)(C)N(ON2C(C)(C)CC(C)CC2(C)C)C(C)(C)C1.
What is the InChIKey of 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine?
The InChIKey is GTZIRGRXHUPURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40N2O/c1-15-11-17(3,4)21(18(5,6)12-15)23-22-19(7,8)13-16(2)14-20(22,9)10/h15-16H,11-14H2,1-10H3.
What are the key properties of 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine?
2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine has a molecular weight of 324.55 g/mol, XLogP of 5.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,6,6-pentamethyl-1-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxypiperidine is sourced from PubChem (CID 21182099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).