3,5,5,6,6-pentamethylpiperidin-2-one

C10H19NO — CID 138971121

IUPAC3,5,5,6,6-pentamethylpiperidin-2-one
SMILESCC1CC(C)(C)C(C)(C)NC1=O
InChIInChI=1S/C10H19NO/c1-7-6-9(2,3)10(4,5)11-8(7)12/h7H,6H2,1-5H3,(H,11,12)
InChIKeyGCUJGLANYBOORU-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds

About 3,5,5,6,6-pentamethylpiperidin-2-one

3,5,5,6,6-pentamethylpiperidin-2-one (PubChem CID 138971121) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 3,5,5,6,6-pentamethylpiperidin-2-one.

Molecular Properties

Compound Name3,5,5,6,6-pentamethylpiperidin-2-one
PubChem CID138971121
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name3,5,5,6,6-pentamethylpiperidin-2-one
SMILESCC1CC(C)(C)C(C)(C)NC1=O
InChIInChI=1S/C10H19NO/c1-7-6-9(2,3)10(4,5)11-8(7)12/h7H,6H2,1-5H3,(H,11,12)
InChIKeyGCUJGLANYBOORU-UHFFFAOYSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,5,5,6,6-pentamethylpiperidin-2-one?
The IUPAC name of 3,5,5,6,6-pentamethylpiperidin-2-one (CID 138971121) is 3,5,5,6,6-pentamethylpiperidin-2-one.
What is the SMILES notation for 3,5,5,6,6-pentamethylpiperidin-2-one?
The canonical SMILES for 3,5,5,6,6-pentamethylpiperidin-2-one is CC1CC(C)(C)C(C)(C)NC1=O.
What is the InChIKey of 3,5,5,6,6-pentamethylpiperidin-2-one?
The InChIKey is GCUJGLANYBOORU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7-6-9(2,3)10(4,5)11-8(7)12/h7H,6H2,1-5H3,(H,11,12).
What are the key properties of 3,5,5,6,6-pentamethylpiperidin-2-one?
3,5,5,6,6-pentamethylpiperidin-2-one has a molecular weight of 169.27 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,5,6,6-pentamethylpiperidin-2-one is sourced from PubChem (CID 138971121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).