2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine

C28H56N2O — CID 21182097

IUPAC2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine
SMILESCCC1(CC)CC(C)CC(CC)(CC)N1ON1C(CC)(CC)CC(C)CC1(CC)CC
InChIInChI=1S/C28H56N2O/c1-11-25(12-2)19-23(9)20-26(13-3,14-4)29(25)31-30-27(15-5,16-6)21-24(10)22-28(30,17-7)18-8/h23-24H,11-22H2,1-10H3
InChIKeyDXKIOQPJZDGJQD-UHFFFAOYSA-N
MW436.77 g/mol
LogP8.53
Rot. Bonds10

About 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine

2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine (PubChem CID 21182097) has the molecular formula C28H56N2O and a molecular weight of 436.77 g/mol. Its IUPAC name is 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine.

Molecular Properties

Compound Name2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine
PubChem CID21182097
Molecular FormulaC28H56N2O
Molecular Weight436.77 g/mol
Exact Mass436.44
IUPAC Name2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine
SMILESCCC1(CC)CC(C)CC(CC)(CC)N1ON1C(CC)(CC)CC(C)CC1(CC)CC
InChIInChI=1S/C28H56N2O/c1-11-25(12-2)19-23(9)20-26(13-3,14-4)29(25)31-30-27(15-5,16-6)21-24(10)22-28(30,17-7)18-8/h23-24H,11-22H2,1-10H3
InChIKeyDXKIOQPJZDGJQD-UHFFFAOYSA-N
XLogP8.53
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.77
LogP ≤ 58.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine?
The IUPAC name of 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine (CID 21182097) is 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine.
What is the SMILES notation for 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine?
The canonical SMILES for 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine is CCC1(CC)CC(C)CC(CC)(CC)N1ON1C(CC)(CC)CC(C)CC1(CC)CC.
What is the InChIKey of 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine?
The InChIKey is DXKIOQPJZDGJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H56N2O/c1-11-25(12-2)19-23(9)20-26(13-3,14-4)29(25)31-30-27(15-5,16-6)21-24(10)22-28(30,17-7)18-8/h23-24H,11-22H2,1-10H3.
What are the key properties of 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine?
2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine has a molecular weight of 436.77 g/mol, XLogP of 8.53, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetraethyl-4-methyl-1-(2,2,6,6-tetraethyl-4-methylpiperidin-1-yl)oxypiperidine is sourced from PubChem (CID 21182097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).