5,6-dimethyl-4-propan-2-ylpiperidin-2-one

C10H19NO — CID 3051329

IUPAC5,6-dimethyl-4-propan-2-ylpiperidin-2-one
SMILESCC(C)C1CC(=O)NC(C)C1C
InChIInChI=1S/C10H19NO/c1-6(2)9-5-10(12)11-8(4)7(9)3/h6-9H,5H2,1-4H3,(H,11,12)
InChIKeyQCJLCDORHATVMG-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.80
Rot. Bonds1

About 5,6-dimethyl-4-propan-2-ylpiperidin-2-one

5,6-dimethyl-4-propan-2-ylpiperidin-2-one (PubChem CID 3051329) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 5,6-dimethyl-4-propan-2-ylpiperidin-2-one.

Molecular Properties

Compound Name5,6-dimethyl-4-propan-2-ylpiperidin-2-one
PubChem CID3051329
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name5,6-dimethyl-4-propan-2-ylpiperidin-2-one
SMILESCC(C)C1CC(=O)NC(C)C1C
InChIInChI=1S/C10H19NO/c1-6(2)9-5-10(12)11-8(4)7(9)3/h6-9H,5H2,1-4H3,(H,11,12)
InChIKeyQCJLCDORHATVMG-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-4-propan-2-ylpiperidin-2-one?
The IUPAC name of 5,6-dimethyl-4-propan-2-ylpiperidin-2-one (CID 3051329) is 5,6-dimethyl-4-propan-2-ylpiperidin-2-one.
What is the SMILES notation for 5,6-dimethyl-4-propan-2-ylpiperidin-2-one?
The canonical SMILES for 5,6-dimethyl-4-propan-2-ylpiperidin-2-one is CC(C)C1CC(=O)NC(C)C1C.
What is the InChIKey of 5,6-dimethyl-4-propan-2-ylpiperidin-2-one?
The InChIKey is QCJLCDORHATVMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-6(2)9-5-10(12)11-8(4)7(9)3/h6-9H,5H2,1-4H3,(H,11,12).
What are the key properties of 5,6-dimethyl-4-propan-2-ylpiperidin-2-one?
5,6-dimethyl-4-propan-2-ylpiperidin-2-one has a molecular weight of 169.27 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-4-propan-2-ylpiperidin-2-one is sourced from PubChem (CID 3051329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).