3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione

C14H23N3O3 — CID 24979519

IUPAC3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1CC(C)CN(C(=O)CN2C(=O)NC(C)(C)C2=O)C1
InChIInChI=1S/C14H23N3O3/c1-9-5-10(2)7-16(6-9)11(18)8-17-12(19)14(3,4)15-13(17)20/h9-10H,5-8H2,1-4H3,(H,15,20)
InChIKeyJVAMXJMHNXSPRQ-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.82
Rot. Bonds2

About 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione

3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 24979519) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID24979519
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1CC(C)CN(C(=O)CN2C(=O)NC(C)(C)C2=O)C1
InChIInChI=1S/C14H23N3O3/c1-9-5-10(2)7-16(6-9)11(18)8-17-12(19)14(3,4)15-13(17)20/h9-10H,5-8H2,1-4H3,(H,15,20)
InChIKeyJVAMXJMHNXSPRQ-UHFFFAOYSA-N
XLogP0.82
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione 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 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione (CID 24979519) is 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione is CC1CC(C)CN(C(=O)CN2C(=O)NC(C)(C)C2=O)C1.
What is the InChIKey of 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is JVAMXJMHNXSPRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-9-5-10(2)7-16(6-9)11(18)8-17-12(19)14(3,4)15-13(17)20/h9-10H,5-8H2,1-4H3,(H,15,20).
What are the key properties of 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 281.36 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 24979519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).