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

C19H21NO — CID 2841186

IUPAC3-ethyl-2,6-diphenylpiperidin-4-one
SMILESCCC1C(=O)CC(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C19H21NO/c1-2-16-18(21)13-17(14-9-5-3-6-10-14)20-19(16)15-11-7-4-8-12-15/h3-12,16-17,19-20H,2,13H2,1H3
InChIKeyMLPXDRONNNYCQN-UHFFFAOYSA-N
MW279.38 g/mol
LogP4.06
Rot. Bonds3

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

3-ethyl-2,6-diphenylpiperidin-4-one (PubChem CID 2841186) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is 3-ethyl-2,6-diphenylpiperidin-4-one.

Molecular Properties

Compound Name3-ethyl-2,6-diphenylpiperidin-4-one
PubChem CID2841186
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name3-ethyl-2,6-diphenylpiperidin-4-one
SMILESCCC1C(=O)CC(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C19H21NO/c1-2-16-18(21)13-17(14-9-5-3-6-10-14)20-19(16)15-11-7-4-8-12-15/h3-12,16-17,19-20H,2,13H2,1H3
InChIKeyMLPXDRONNNYCQN-UHFFFAOYSA-N
XLogP4.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,6-diphenylpiperidin-4-one?
The IUPAC name of 3-ethyl-2,6-diphenylpiperidin-4-one (CID 2841186) is 3-ethyl-2,6-diphenylpiperidin-4-one.
What is the SMILES notation for 3-ethyl-2,6-diphenylpiperidin-4-one?
The canonical SMILES for 3-ethyl-2,6-diphenylpiperidin-4-one is CCC1C(=O)CC(c2ccccc2)NC1c1ccccc1.
What is the InChIKey of 3-ethyl-2,6-diphenylpiperidin-4-one?
The InChIKey is MLPXDRONNNYCQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-2-16-18(21)13-17(14-9-5-3-6-10-14)20-19(16)15-11-7-4-8-12-15/h3-12,16-17,19-20H,2,13H2,1H3.
What are the key properties of 3-ethyl-2,6-diphenylpiperidin-4-one?
3-ethyl-2,6-diphenylpiperidin-4-one has a molecular weight of 279.38 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,6-diphenylpiperidin-4-one is sourced from PubChem (CID 2841186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).