3-benzyl-2,6-diphenylpiperidin-4-one

C24H23NO — CID 3089030

IUPAC3-benzyl-2,6-diphenylpiperidin-4-one
SMILESO=C1CC(c2ccccc2)NC(c2ccccc2)C1Cc1ccccc1
InChIInChI=1S/C24H23NO/c26-23-17-22(19-12-6-2-7-13-19)25-24(20-14-8-3-9-15-20)21(23)16-18-10-4-1-5-11-18/h1-15,21-22,24-25H,16-17H2
InChIKeyZHMWAECVOGMYGO-UHFFFAOYSA-N
MW341.45 g/mol
LogP4.89
Rot. Bonds4

About 3-benzyl-2,6-diphenylpiperidin-4-one

3-benzyl-2,6-diphenylpiperidin-4-one (PubChem CID 3089030) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is 3-benzyl-2,6-diphenylpiperidin-4-one.

Molecular Properties

Compound Name3-benzyl-2,6-diphenylpiperidin-4-one
PubChem CID3089030
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC Name3-benzyl-2,6-diphenylpiperidin-4-one
SMILESO=C1CC(c2ccccc2)NC(c2ccccc2)C1Cc1ccccc1
InChIInChI=1S/C24H23NO/c26-23-17-22(19-12-6-2-7-13-19)25-24(20-14-8-3-9-15-20)21(23)16-18-10-4-1-5-11-18/h1-15,21-22,24-25H,16-17H2
InChIKeyZHMWAECVOGMYGO-UHFFFAOYSA-N
XLogP4.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-benzyl-2,6-diphenylpiperidin-4-one?
The IUPAC name of 3-benzyl-2,6-diphenylpiperidin-4-one (CID 3089030) is 3-benzyl-2,6-diphenylpiperidin-4-one.
What is the SMILES notation for 3-benzyl-2,6-diphenylpiperidin-4-one?
The canonical SMILES for 3-benzyl-2,6-diphenylpiperidin-4-one is O=C1CC(c2ccccc2)NC(c2ccccc2)C1Cc1ccccc1.
What is the InChIKey of 3-benzyl-2,6-diphenylpiperidin-4-one?
The InChIKey is ZHMWAECVOGMYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO/c26-23-17-22(19-12-6-2-7-13-19)25-24(20-14-8-3-9-15-20)21(23)16-18-10-4-1-5-11-18/h1-15,21-22,24-25H,16-17H2.
What are the key properties of 3-benzyl-2,6-diphenylpiperidin-4-one?
3-benzyl-2,6-diphenylpiperidin-4-one has a molecular weight of 341.45 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-2,6-diphenylpiperidin-4-one is sourced from PubChem (CID 3089030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).