3-ethyl-4,4-dipropylpiperidine-2,6-dione

C13H23NO2 — CID 79321261

IUPAC3-ethyl-4,4-dipropylpiperidine-2,6-dione
SMILESCCCC1(CCC)CC(=O)NC(=O)C1CC
InChIInChI=1S/C13H23NO2/c1-4-7-13(8-5-2)9-11(15)14-12(16)10(13)6-3/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyTYJVDDLOLPHHRZ-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.65
Rot. Bonds5

About 3-ethyl-4,4-dipropylpiperidine-2,6-dione

3-ethyl-4,4-dipropylpiperidine-2,6-dione (PubChem CID 79321261) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 3-ethyl-4,4-dipropylpiperidine-2,6-dione.

Molecular Properties

Compound Name3-ethyl-4,4-dipropylpiperidine-2,6-dione
PubChem CID79321261
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name3-ethyl-4,4-dipropylpiperidine-2,6-dione
SMILESCCCC1(CCC)CC(=O)NC(=O)C1CC
InChIInChI=1S/C13H23NO2/c1-4-7-13(8-5-2)9-11(15)14-12(16)10(13)6-3/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyTYJVDDLOLPHHRZ-UHFFFAOYSA-N
XLogP2.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 3-ethyl-4,4-dipropylpiperidine-2,6-dione 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

4-methyl-3,4-dipropylpiperidine-2,6-dione
CID 79317576
5-ethyl-9-propyl-3-azaspiro[5.5]undecane-2,4-dione
CID 79321157
3,10-diethyl-8-azaspiro[4.5]decane-7,9-dione
CID 79321543
9-tert-butyl-5-ethyl-3-azaspiro[5.5]undecane-2,4-dione
CID 79321065
4-methyl-4-(3-methylbutyl)-3-propylpiperidine-2,6-dione
CID 79318435
11-ethyl-2,2-dioxo-2λ6-thia-9-azaspiro[5.5]undecane-8,10-dione
CID 79320480
3-methyl-4,4-bis(2-methylpropyl)piperidine-2,6-dione
CID 114867239
4-ethyl-3,3-dimethylpyrrolidine-2,5-dione
CID 523535
2-methyl-6-propyl-2,8-diazaspiro[4.5]decane-7,9-dione
CID 79318050
4,4-bis(2-methylpropyl)-3-propan-2-ylpiperidine-2,6-dione
CID 114867248
3-(2-chlorophenyl)-4-methyl-4-propylpiperidine-2,6-dione
CID 79454345
ethane;propane;3-sulfanylpyrrolidine-2,5-dione
CID 144975396

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4,4-dipropylpiperidine-2,6-dione?
The IUPAC name of 3-ethyl-4,4-dipropylpiperidine-2,6-dione (CID 79321261) is 3-ethyl-4,4-dipropylpiperidine-2,6-dione.
What is the SMILES notation for 3-ethyl-4,4-dipropylpiperidine-2,6-dione?
The canonical SMILES for 3-ethyl-4,4-dipropylpiperidine-2,6-dione is CCCC1(CCC)CC(=O)NC(=O)C1CC.
What is the InChIKey of 3-ethyl-4,4-dipropylpiperidine-2,6-dione?
The InChIKey is TYJVDDLOLPHHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-4-7-13(8-5-2)9-11(15)14-12(16)10(13)6-3/h10H,4-9H2,1-3H3,(H,14,15,16).
What are the key properties of 3-ethyl-4,4-dipropylpiperidine-2,6-dione?
3-ethyl-4,4-dipropylpiperidine-2,6-dione has a molecular weight of 225.33 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4,4-dipropylpiperidine-2,6-dione is sourced from PubChem (CID 79321261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).