3,5,5-tritert-butylimidazolidine-2,4-dione

C15H28N2O2 — CID 166023009

IUPAC3,5,5-tritert-butylimidazolidine-2,4-dione
SMILESCC(C)(C)N1C(=O)NC(C(C)(C)C)(C(C)(C)C)C1=O
InChIInChI=1S/C15H28N2O2/c1-12(2,3)15(13(4,5)6)10(18)17(11(19)16-15)14(7,8)9/h1-9H3,(H,16,19)
InChIKeySICRXNLHGOKHGW-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.17
Rot. Bonds

About 3,5,5-tritert-butylimidazolidine-2,4-dione

3,5,5-tritert-butylimidazolidine-2,4-dione (PubChem CID 166023009) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3,5,5-tritert-butylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3,5,5-tritert-butylimidazolidine-2,4-dione
PubChem CID166023009
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3,5,5-tritert-butylimidazolidine-2,4-dione
SMILESCC(C)(C)N1C(=O)NC(C(C)(C)C)(C(C)(C)C)C1=O
InChIInChI=1S/C15H28N2O2/c1-12(2,3)15(13(4,5)6)10(18)17(11(19)16-15)14(7,8)9/h1-9H3,(H,16,19)
InChIKeySICRXNLHGOKHGW-UHFFFAOYSA-N
XLogP3.17
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3,5,5-tritert-butylimidazolidine-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 3,5,5-tritert-butylimidazolidine-2,4-dione?
The IUPAC name of 3,5,5-tritert-butylimidazolidine-2,4-dione (CID 166023009) is 3,5,5-tritert-butylimidazolidine-2,4-dione.
What is the SMILES notation for 3,5,5-tritert-butylimidazolidine-2,4-dione?
The canonical SMILES for 3,5,5-tritert-butylimidazolidine-2,4-dione is CC(C)(C)N1C(=O)NC(C(C)(C)C)(C(C)(C)C)C1=O.
What is the InChIKey of 3,5,5-tritert-butylimidazolidine-2,4-dione?
The InChIKey is SICRXNLHGOKHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(2,3)15(13(4,5)6)10(18)17(11(19)16-15)14(7,8)9/h1-9H3,(H,16,19).
What are the key properties of 3,5,5-tritert-butylimidazolidine-2,4-dione?
3,5,5-tritert-butylimidazolidine-2,4-dione has a molecular weight of 268.40 g/mol, XLogP of 3.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,5-tritert-butylimidazolidine-2,4-dione is sourced from PubChem (CID 166023009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).