3-butyl-5,5-diphenylimidazolidine-2,4-dione

C19H20N2O2 — CID 13484727

IUPAC3-butyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C19H20N2O2/c1-2-3-14-21-17(22)19(20-18(21)23,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3,(H,20,23)
InChIKeyNSAQJIOXNYXOKM-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.28
Rot. Bonds5

About 3-butyl-5,5-diphenylimidazolidine-2,4-dione

3-butyl-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 13484727) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 3-butyl-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-butyl-5,5-diphenylimidazolidine-2,4-dione
PubChem CID13484727
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name3-butyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C19H20N2O2/c1-2-3-14-21-17(22)19(20-18(21)23,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3,(H,20,23)
InChIKeyNSAQJIOXNYXOKM-UHFFFAOYSA-N
XLogP3.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-butyl-5,5-diphenylimidazolidine-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-butyl-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-butyl-5,5-diphenylimidazolidine-2,4-dione (CID 13484727) is 3-butyl-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-butyl-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-butyl-5,5-diphenylimidazolidine-2,4-dione is CCCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 3-butyl-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is NSAQJIOXNYXOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-2-3-14-21-17(22)19(20-18(21)23,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3,(H,20,23).
What are the key properties of 3-butyl-5,5-diphenylimidazolidine-2,4-dione?
3-butyl-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 308.38 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 13484727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).