4-[3-(Biphenyl-2-yloxy)-propyl]-morpholine

HCID 2298326

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: c1ccc(-c2ccccc2OCCCN2CCOCC2)cc1
InChIKey: KHLKQGVEAQVFKH-UHFFFAOYSA-N
Molecular formula: C19H23NO2
Average molar mass: 297.4 g/mol

Names & identifiers

Preferred name: 4-[3-(Biphenyl-2-yloxy)-propyl]-morpholine
IUPAC: 4-[3-(2-phenylphenoxy)propyl]morpholine

Names & synonyms

4-[3-(2-biphenylyloxy)propyl]morpholine oxalateCambridge id 7009627SCHEMBL4857927CHEMBL1619027SCHEMBL21408616KHLKQGVEAQVFKH-UHFFFAOYSA-N4-[3-(biphenyl-2-yloxy)-propyl]-morpholine

Database identifiers

PubChem CID: 2298326
ChEMBL: CHEMBL1619027

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 21.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 22
Formal charge: 0
Complexity: 298

Related reactions

6 records

New reaction record

HRID 94771As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 271103As productuspto-grants-2008_11

HRID 271104As reactantuspto-grants-2008_11

HRID 895361As productuspto-grants-2005_07

HRID 895362As reactantuspto-grants-2005_07

HRID 946387As productValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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