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3-Piperidin-1-yl-pyrrolidin-2-one

HCID 57658013
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1NCCC1N1CCCCC1
InChIKey
ZDXHCYNVJRTYPZ-UHFFFAOYSA-N
Molecular formula
C9H16N2O
Average molar mass
168.24 g/mol
Monoisotopic mass
168.12626314

Names & identifiers

Preferred name
3-Piperidin-1-yl-pyrrolidin-2-one
IUPAC
3-piperidin-1-ylpyrrolidin-2-one

Names & synonyms

SCHEMBL2301305ZDXHCYNVJRTYPZ-UHFFFAOYSA-N3-Piperidin-1-yl-pyrrolidin-2-one

Database identifiers

PubChem CID
57658013

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
175

Related reactions

3 records
New reaction record
HRID 1670824 reaction equation
HRID 1670824As productuspto-grants-2011_08
HRID 1670841 reaction equation
HRID 1670841As reactantuspto-grants-2011_08
HRID 2346603 reaction equation
HRID 2346603As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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