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2-(4-Heptyl-4-piperidyloxy)-ethanol

HCID 21440901
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCCCCC1(OCCO)CCNCC1
InChIKey
FTFSXPWFFUJJAB-UHFFFAOYSA-N
Molecular formula
C14H29NO2
Average molar mass
243.39 g/mol

Names & identifiers

Preferred name
2-(4-Heptyl-4-piperidyloxy)-ethanol
IUPAC
2-(4-heptylpiperidin-4-yl)oxyethanol

Names & synonyms

SCHEMBL11688093FTFSXPWFFUJJAB-UHFFFAOYSA-N2-(4-heptyl-4-piperidyloxy)-ethanol

Database identifiers

PubChem CID
21440901

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
41.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
17
Formal charge
0
Complexity
179

Related reactions

3 records
New reaction record
HRID 300371 reaction equation
HRID 300371As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 329035 reaction equation
HRID 329035As productuspto-grants-1977_04
HRID 329049 reaction equation
HRID 329049As reactantuspto-grants-1977_04

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes