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5-Benzyloxy-2-[2-(1-pyrrolidinyl)ethyl]4-pyridone

HCID 67748091
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1CC(CCN2CCCC2)=NC=C1OCc1ccccc1
InChIKey
AXTAELKYGDRQNE-UHFFFAOYSA-N
Molecular formula
C18H22N2O2
Average molar mass
298.4 g/mol

Names & identifiers

Preferred name
5-Benzyloxy-2-[2-(1-pyrrolidinyl)ethyl]4-pyridone
IUPAC
5-phenylmethoxy-2-(2-pyrrolidin-1-ylethyl)-3H-pyridin-4-one

Names & synonyms

SCHEMBL9013188AXTAELKYGDRQNE-UHFFFAOYSA-N5-benzyloxy-2-[2-(1-pyrrolidinyl)ethyl]4-pyridone5-benzyloxy-2-[2-(1-pyrrolidinyl)ethyl]-4-pyridone

Database identifiers

PubChem CID
67748091

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
41.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
444

Related reactions

4 records
New reaction record
HRID 5514 reaction equation
HRID 5514As productuspto-grants-1993_09
HRID 1138697 reaction equation
HRID 1138697As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1609649 reaction equation
HRID 1609649As productuspto-grants-1995_03
HRID 1734252 reaction equation
HRID 1734252As productuspto-grants-1996_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes