3,3-Diphenylpiperidin-2-one

Substructure search Find similar structures

Basic information

CAS: 24056-59-5
Standard SMILES: O=C1NCCCC1(c1ccccc1)c1ccccc1
InChIKey: SMBVZADXTNEBQL-UHFFFAOYSA-N
Molecular formula: C17H17NO
Average molar mass: 251.32 g/mol
Monoisotopic mass: 251.13101417

Names & identifiers

Preferred name: 3,3-Diphenylpiperidin-2-one
IUPAC: 3,3-diphenylpiperidin-2-one

Names & synonyms

24056-59-5MLS0031154093,3-diphenylpiperidin-2-one3,3-diphenyl-2-PiperidinoneNSC270583SCHEMBL2313192CHEMBL1898820DTXSID10946905SMBVZADXTNEBQL-UHFFFAOYSA-NNSC-270583SMR001830986DB-365708

Show more names

3,3-Diphenyl-3,4,5,6-tetrahydropyridin-2-ol5217-80-1

Database identifiers

CAS: 24056-59-5
PubChem CID: 321165
DTXSID: DTXSID10946905
ChEMBL: CHEMBL1898820
Nikkaji: J1.628.521H

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 19
Formal charge: 0
Complexity: 295

Related reactions

9 records

New reaction record

HRID 101138As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 156905As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 1667087As reactantuspto-grants-2011_10

HRID 1667143As productuspto-grants-2011_10

HRID 1667144As reactantuspto-grants-2011_10

HRID 1667208As reactantuspto-grants-2011_10

HRID 2346007As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

HRID 2408824As productuspto-grants-2014_08

Compound notes

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