2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine

C17H35NO2 — CID 90921414

IUPAC2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine
SMILESCCCCCOC1CC(C)(CC)N(O)C(C)(CC)C1C
InChIInChI=1S/C17H35NO2/c1-7-10-11-12-20-15-13-16(5,8-2)18(19)17(6,9-3)14(15)4/h14-15,19H,7-13H2,1-6H3
InChIKeyHYZXZVIGSHGOKN-UHFFFAOYSA-N
MW285.47 g/mol
LogP4.63
Rot. Bonds7

About 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine

2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine (PubChem CID 90921414) has the molecular formula C17H35NO2 and a molecular weight of 285.47 g/mol. Its IUPAC name is 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine.

Molecular Properties

Compound Name2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine
PubChem CID90921414
Molecular FormulaC17H35NO2
Molecular Weight285.47 g/mol
Exact Mass285.27
IUPAC Name2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine
SMILESCCCCCOC1CC(C)(CC)N(O)C(C)(CC)C1C
InChIInChI=1S/C17H35NO2/c1-7-10-11-12-20-15-13-16(5,8-2)18(19)17(6,9-3)14(15)4/h14-15,19H,7-13H2,1-6H3
InChIKeyHYZXZVIGSHGOKN-UHFFFAOYSA-N
XLogP4.63
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.47
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2,6-diethyl-1-hydroxy-2,3,6-trimethylpiperidin-4-yl) formate
CID 91405439
1,2,2,6,6-pentamethyl-4-octoxypiperidine
CID 155074808
octyl 2,6-diethyl-2,3,6-trimethylpiperidine-1-carboxylate
CID 22754576
2-(2,6-diethyl-4-methoxy-2,3,6-trimethylpiperidin-1-yl)ethanol
CID 21330339
2,6-diethyl-1-hydroxy-2,3,6-trimethylpiperidine
CID 21361389
2-ethyl-1-hydroxy-2,3,6,6-tetramethylpiperidin-4-ol
CID 143807942
bis(2,6-diethyl-1,2,3,6-tetramethylpiperidin-4-yl) decanedioate
CID 22323173
2,6-diethyl-2,3,6-trimethyl-4-propoxypiperidine
CID 140997283
CID 90849890
CID 90849890
3-decyl-7,9-diethyl-8-hydroxy-6,7,9-trimethyl-1,4-dioxa-8-azaspiro[4.5]decane
CID 68838027
4-decoxy-2,2,6,6-tetramethylpiperidine
CID 141105994
2-bromo-3-pentoxythietane
CID 134299927

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine?
The IUPAC name of 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine (CID 90921414) is 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine.
What is the SMILES notation for 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine?
The canonical SMILES for 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine is CCCCCOC1CC(C)(CC)N(O)C(C)(CC)C1C.
What is the InChIKey of 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine?
The InChIKey is HYZXZVIGSHGOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO2/c1-7-10-11-12-20-15-13-16(5,8-2)18(19)17(6,9-3)14(15)4/h14-15,19H,7-13H2,1-6H3.
What are the key properties of 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine?
2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine has a molecular weight of 285.47 g/mol, XLogP of 4.63, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-1-hydroxy-2,3,6-trimethyl-4-pentoxypiperidine is sourced from PubChem (CID 90921414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).