6,6-dimethyl-3-propan-2-ylpiperidin-2-one

C10H19NO — CID 157148346

IUPAC6,6-dimethyl-3-propan-2-ylpiperidin-2-one
SMILESCC(C)C1CCC(C)(C)NC1=O
InChIInChI=1S/C10H19NO/c1-7(2)8-5-6-10(3,4)11-9(8)12/h7-8H,5-6H2,1-4H3,(H,11,12)
InChIKeyDPRFMKSILHPUSV-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds1

About 6,6-dimethyl-3-propan-2-ylpiperidin-2-one

6,6-dimethyl-3-propan-2-ylpiperidin-2-one (PubChem CID 157148346) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 6,6-dimethyl-3-propan-2-ylpiperidin-2-one.

Molecular Properties

Compound Name6,6-dimethyl-3-propan-2-ylpiperidin-2-one
PubChem CID157148346
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name6,6-dimethyl-3-propan-2-ylpiperidin-2-one
SMILESCC(C)C1CCC(C)(C)NC1=O
InChIInChI=1S/C10H19NO/c1-7(2)8-5-6-10(3,4)11-9(8)12/h7-8H,5-6H2,1-4H3,(H,11,12)
InChIKeyDPRFMKSILHPUSV-UHFFFAOYSA-N
XLogP1.95
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 ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 6,6-dimethyl-3-propan-2-ylpiperidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-3-propan-2-ylpiperidin-2-one?
The IUPAC name of 6,6-dimethyl-3-propan-2-ylpiperidin-2-one (CID 157148346) is 6,6-dimethyl-3-propan-2-ylpiperidin-2-one.
What is the SMILES notation for 6,6-dimethyl-3-propan-2-ylpiperidin-2-one?
The canonical SMILES for 6,6-dimethyl-3-propan-2-ylpiperidin-2-one is CC(C)C1CCC(C)(C)NC1=O.
What is the InChIKey of 6,6-dimethyl-3-propan-2-ylpiperidin-2-one?
The InChIKey is DPRFMKSILHPUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)8-5-6-10(3,4)11-9(8)12/h7-8H,5-6H2,1-4H3,(H,11,12).
What are the key properties of 6,6-dimethyl-3-propan-2-ylpiperidin-2-one?
6,6-dimethyl-3-propan-2-ylpiperidin-2-one has a molecular weight of 169.27 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-3-propan-2-ylpiperidin-2-one is sourced from PubChem (CID 157148346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).