2,6-diphenylpiperidin-4-one

C17H17NO — CID 2828708

IUPAC2,6-diphenylpiperidin-4-one
SMILESO=C1CC(c2ccccc2)NC(c2ccccc2)C1
InChIInChI=1S/C17H17NO/c19-15-11-16(13-7-3-1-4-8-13)18-17(12-15)14-9-5-2-6-10-14/h1-10,16-18H,11-12H2
InChIKeyOYKOHBSCVHNWPT-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.42
Rot. Bonds2

About 2,6-diphenylpiperidin-4-one

2,6-diphenylpiperidin-4-one (PubChem CID 2828708) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is 2,6-diphenylpiperidin-4-one.

Molecular Properties

Compound Name2,6-diphenylpiperidin-4-one
PubChem CID2828708
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name2,6-diphenylpiperidin-4-one
SMILESO=C1CC(c2ccccc2)NC(c2ccccc2)C1
InChIInChI=1S/C17H17NO/c19-15-11-16(13-7-3-1-4-8-13)18-17(12-15)14-9-5-2-6-10-14/h1-10,16-18H,11-12H2
InChIKeyOYKOHBSCVHNWPT-UHFFFAOYSA-N
XLogP3.42
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-diphenylpiperidin-4-one?
The IUPAC name of 2,6-diphenylpiperidin-4-one (CID 2828708) is 2,6-diphenylpiperidin-4-one.
What is the SMILES notation for 2,6-diphenylpiperidin-4-one?
The canonical SMILES for 2,6-diphenylpiperidin-4-one is O=C1CC(c2ccccc2)NC(c2ccccc2)C1.
What is the InChIKey of 2,6-diphenylpiperidin-4-one?
The InChIKey is OYKOHBSCVHNWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c19-15-11-16(13-7-3-1-4-8-13)18-17(12-15)14-9-5-2-6-10-14/h1-10,16-18H,11-12H2.
What are the key properties of 2,6-diphenylpiperidin-4-one?
2,6-diphenylpiperidin-4-one has a molecular weight of 251.33 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenylpiperidin-4-one is sourced from PubChem (CID 2828708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).