1-(2,2-dimethylpropyl)piperidin-2-one

C10H19NO — CID 22960537

IUPAC1-(2,2-dimethylpropyl)piperidin-2-one
SMILESCC(C)(C)CN1CCCCC1=O
InChIInChI=1S/C10H19NO/c1-10(2,3)8-11-7-5-4-6-9(11)12/h4-8H2,1-3H3
InChIKeyGAEQLEWYBBXXKY-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.05
Rot. Bonds1

About 1-(2,2-dimethylpropyl)piperidin-2-one

1-(2,2-dimethylpropyl)piperidin-2-one (PubChem CID 22960537) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)piperidin-2-one.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)piperidin-2-one
PubChem CID22960537
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(2,2-dimethylpropyl)piperidin-2-one
SMILESCC(C)(C)CN1CCCCC1=O
InChIInChI=1S/C10H19NO/c1-10(2,3)8-11-7-5-4-6-9(11)12/h4-8H2,1-3H3
InChIKeyGAEQLEWYBBXXKY-UHFFFAOYSA-N
XLogP2.05
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(2,2-dimethylpropyl)piperidin-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 1-(2,2-dimethylpropyl)piperidin-2-one?
The IUPAC name of 1-(2,2-dimethylpropyl)piperidin-2-one (CID 22960537) is 1-(2,2-dimethylpropyl)piperidin-2-one.
What is the SMILES notation for 1-(2,2-dimethylpropyl)piperidin-2-one?
The canonical SMILES for 1-(2,2-dimethylpropyl)piperidin-2-one is CC(C)(C)CN1CCCCC1=O.
What is the InChIKey of 1-(2,2-dimethylpropyl)piperidin-2-one?
The InChIKey is GAEQLEWYBBXXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10(2,3)8-11-7-5-4-6-9(11)12/h4-8H2,1-3H3.
What are the key properties of 1-(2,2-dimethylpropyl)piperidin-2-one?
1-(2,2-dimethylpropyl)piperidin-2-one has a molecular weight of 169.27 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)piperidin-2-one is sourced from PubChem (CID 22960537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).