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1-(4-Hydroxypiperidin-1-yl)-3-phenylpropan-1-one

HCID 22175162
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(CCc1ccccc1)N1CCC(O)CC1
InChIKey
JUMBEHLEQICDSF-UHFFFAOYSA-N
Molecular formula
C14H19NO2
Average molar mass
233.31 g/mol

Names & identifiers

Preferred name
1-(4-Hydroxypiperidin-1-yl)-3-phenylpropan-1-one
IUPAC
1-(4-hydroxypiperidin-1-yl)-3-phenylpropan-1-one

Names & synonyms

1-(4-hydroxypiperidin-1-yl)-3-phenylpropan-1-one321597-49-3SCHEMBL4704100SCHEMBL6289171SCHEMBL27463118JUMBEHLEQICDSF-UHFFFAOYSA-NAKOS0089849151-(3-phenylpropionyl)-4-hydroxypiperidineA1-109522F1908-0829

Database identifiers

PubChem CID
22175162

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
40.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
241

Related reactions

12 records
New reaction record
HRID 49445 reaction equation
HRID 49445As reactantuspto-grants-2004_03
HRID 101894 reaction equation
HRID 101894As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 277159 reaction equation
HRID 277159As productuspto-grants-2002_03
HRID 277160 reaction equation
HRID 277160As reactantuspto-grants-2002_03
HRID 584720 reaction equation
HRID 584720As productuspto-grants-2005_08
HRID 584721 reaction equation
HRID 584721As reactantuspto-grants-2005_08
HRID 1059677 reaction equation
HRID 1059677As reactantuspto-grants-2003_02
HRID 1797036 reaction equation
HRID 1797036As productuspto-grants-2006_04
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Compound notes

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