2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine

C12H24NO- — CID 22182255

IUPAC2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine
SMILESCCC1(C)CCC(C)C(C)(CC)N1[O-]
InChIInChI=1S/C12H24NO/c1-6-11(4)9-8-10(3)12(5,7-2)13(11)14/h10H,6-9H2,1-5H3/q-1
InChIKeyWBRPBTPGUXPAJV-UHFFFAOYSA-N
MW198.33 g/mol
LogP3.55
Rot. Bonds2

About 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine

2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine (PubChem CID 22182255) has the molecular formula C12H24NO- and a molecular weight of 198.33 g/mol. Its IUPAC name is 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine.

Molecular Properties

Compound Name2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine
PubChem CID22182255
Molecular FormulaC12H24NO-
Molecular Weight198.33 g/mol
Exact Mass198.19
IUPAC Name2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine
SMILESCCC1(C)CCC(C)C(C)(CC)N1[O-]
InChIInChI=1S/C12H24NO/c1-6-11(4)9-8-10(3)12(5,7-2)13(11)14/h10H,6-9H2,1-5H3/q-1
InChIKeyWBRPBTPGUXPAJV-UHFFFAOYSA-N
XLogP3.55
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-diethyl-1-hydroxy-2,3,6-trimethylpiperidine
CID 21361389
1-[6-(2,6-diethyl-2,3,6-trimethylpiperidin-1-yl)hexyl]-2,6-diethyl-2,3,6-trimethylpiperidine
CID 22754581
2,6-diethyl-2,3,6-trimethylpiperidine-1-carboxamide
CID 57208979
octyl 2,6-diethyl-2,3,6-trimethylpiperidine-1-carboxylate
CID 22754576
2,2-bis[2-(2,6-diethyl-2,3,6-trimethylpiperidin-1-yl)ethyl]decanedioate
CID 22754552
(2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidin-4-yl) acetate
CID 142844351
3-[[2-(2,6-diethyl-2,3,6-trimethylpiperidin-1-yl)oxy-1-hydroxypropyl]amino]propyl-ethyl-dimethylazanium
CID 142844368
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
4,5-diethyl-2,5-dimethylthiomorpholine
CID 163549722
2,6-diethyl-4-methoxy-1,2,3,6-tetramethylpiperidin-4-ol;yttrium
CID 58891864
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711
(1R)-1,2-dimethylcyclobutan-1-amine
CID 147198625

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine?
The IUPAC name of 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine (CID 22182255) is 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine.
What is the SMILES notation for 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine?
The canonical SMILES for 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine is CCC1(C)CCC(C)C(C)(CC)N1[O-].
What is the InChIKey of 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine?
The InChIKey is WBRPBTPGUXPAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24NO/c1-6-11(4)9-8-10(3)12(5,7-2)13(11)14/h10H,6-9H2,1-5H3/q-1.
What are the key properties of 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine?
2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine has a molecular weight of 198.33 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-2,3,6-trimethyl-1-oxidopiperidine is sourced from PubChem (CID 22182255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).