1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one

C13H21NO2 — CID 115276279

IUPAC1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one
SMILESCC1(C)CCC(=O)CN1C(=O)C1CCCC1
InChIInChI=1S/C13H21NO2/c1-13(2)8-7-11(15)9-14(13)12(16)10-5-3-4-6-10/h10H,3-9H2,1-2H3
InChIKeyGQDNTWCEVABRJW-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.15
Rot. Bonds1

About 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one

1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one (PubChem CID 115276279) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one.

Molecular Properties

Compound Name1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one
PubChem CID115276279
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one
SMILESCC1(C)CCC(=O)CN1C(=O)C1CCCC1
InChIInChI=1S/C13H21NO2/c1-13(2)8-7-11(15)9-14(13)12(16)10-5-3-4-6-10/h10H,3-9H2,1-2H3
InChIKeyGQDNTWCEVABRJW-UHFFFAOYSA-N
XLogP2.15
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one with MolForge

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

Launch Full Analysis

Related Compounds

6,6-dimethyl-1-(oxane-4-carbonyl)piperidin-3-one
CID 115269494
1-(4-cyclopentylbutanoyl)-6,6-dimethylpiperidin-3-one
CID 115276326
1-butanoyl-6,6-dimethylpiperidin-3-one
CID 115269445
6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)acetyl]piperidin-3-one
CID 115276298
4-(cyclooctanecarbonyl)-3,3-dimethylpiperazin-2-one
CID 65022862
4-(cyclohexanecarbonyl)piperazine-2,6-dione
CID 13063813
4-(2,2-dimethylpyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63783009
1-(4-ethylbenzoyl)-6,6-dimethylpiperidin-3-one
CID 115276264
(2,2-dimethylpyrrolidin-1-yl)-[(3R)-1,1-dioxothiolan-3-yl]methanone
CID 100671287
(2S)-2-methyl-5-oxopiperidine-1,2-dicarboxylic acid
CID 91509237
1-[2-(4-fluorophenyl)acetyl]-6,6-dimethylpiperidin-3-one
CID 115269472
1-(5-bromothiophene-2-carbonyl)-6,6-dimethylpiperidin-3-one
CID 115276268

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one?
The IUPAC name of 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one (CID 115276279) is 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one.
What is the SMILES notation for 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one?
The canonical SMILES for 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one is CC1(C)CCC(=O)CN1C(=O)C1CCCC1.
What is the InChIKey of 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one?
The InChIKey is GQDNTWCEVABRJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-13(2)8-7-11(15)9-14(13)12(16)10-5-3-4-6-10/h10H,3-9H2,1-2H3.
What are the key properties of 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one?
1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one has a molecular weight of 223.32 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentanecarbonyl)-6,6-dimethylpiperidin-3-one is sourced from PubChem (CID 115276279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).