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2-[1-[2-(2-methoxyphenoxy)ethyl]piperidin-4-yl]-N,N-dimethylethanamine

HCID 19085392
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COc1ccccc1OCCN1CCC(CCN(C)C)CC1
InChIKey
SDIVWJRLJSVIMP-UHFFFAOYSA-N
Molecular formula
C18H30N2O2
Average molar mass
306.4 g/mol

Names & identifiers

Preferred name
2-[1-[2-(2-methoxyphenoxy)ethyl]piperidin-4-yl]-N,N-dimethylethanamine
IUPAC
2-[1-[2-(2-methoxyphenoxy)ethyl]piperidin-4-yl]-N,N-dimethylethanamine

Names & synonyms

SCHEMBL8689819

Database identifiers

PubChem CID
19085392

Properties

Computed structural properties

XLogP
3
Topological polar surface area
24.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
22
Formal charge
0
Complexity
291

Related reactions

1 records
New reaction record
HRID 172494 reaction equation
HRID 172494As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes