(5S,6R)-5,6-diphenylpiperidin-2-one

C17H17NO — CID 67807202

IUPAC(5S,6R)-5,6-diphenylpiperidin-2-one
SMILESO=C1CC[C@@H](c2ccccc2)[C@H](c2ccccc2)N1
InChIInChI=1S/C17H17NO/c19-16-12-11-15(13-7-3-1-4-8-13)17(18-16)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19)/t15-,17-/m0/s1
InChIKeyOBPONSFZJGNQCA-RDJZCZTQSA-N
MW251.33 g/mol
LogP3.42
Rot. Bonds2

About (5S,6R)-5,6-diphenylpiperidin-2-one

(5S,6R)-5,6-diphenylpiperidin-2-one (PubChem CID 67807202) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is (5S,6R)-5,6-diphenylpiperidin-2-one.

Molecular Properties

Compound Name(5S,6R)-5,6-diphenylpiperidin-2-one
PubChem CID67807202
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name(5S,6R)-5,6-diphenylpiperidin-2-one
SMILESO=C1CC[C@@H](c2ccccc2)[C@H](c2ccccc2)N1
InChIInChI=1S/C17H17NO/c19-16-12-11-15(13-7-3-1-4-8-13)17(18-16)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19)/t15-,17-/m0/s1
InChIKeyOBPONSFZJGNQCA-RDJZCZTQSA-N
XLogP3.42
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
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 ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5S,6R)-5,6-diphenylpiperidin-2-one?
The IUPAC name of (5S,6R)-5,6-diphenylpiperidin-2-one (CID 67807202) is (5S,6R)-5,6-diphenylpiperidin-2-one.
What is the SMILES notation for (5S,6R)-5,6-diphenylpiperidin-2-one?
The canonical SMILES for (5S,6R)-5,6-diphenylpiperidin-2-one is O=C1CC[C@@H](c2ccccc2)[C@H](c2ccccc2)N1.
What is the InChIKey of (5S,6R)-5,6-diphenylpiperidin-2-one?
The InChIKey is OBPONSFZJGNQCA-RDJZCZTQSA-N. The full InChI is InChI=1S/C17H17NO/c19-16-12-11-15(13-7-3-1-4-8-13)17(18-16)14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,18,19)/t15-,17-/m0/s1.
What are the key properties of (5S,6R)-5,6-diphenylpiperidin-2-one?
(5S,6R)-5,6-diphenylpiperidin-2-one has a molecular weight of 251.33 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,6R)-5,6-diphenylpiperidin-2-one is sourced from PubChem (CID 67807202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).