1-benzylimidazolidine-2,4,5-trione

C10H8N2O3 — CID 562619

IUPAC1-benzylimidazolidine-2,4,5-trione
SMILESO=C1NC(=O)N(Cc2ccccc2)C1=O
InChIInChI=1S/C10H8N2O3/c13-8-9(14)12(10(15)11-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,13,15)
InChIKeyGGLAGGHAVVZWSQ-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.26
Rot. Bonds2

About 1-benzylimidazolidine-2,4,5-trione

1-benzylimidazolidine-2,4,5-trione (PubChem CID 562619) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 1-benzylimidazolidine-2,4,5-trione.

Molecular Properties

Compound Name1-benzylimidazolidine-2,4,5-trione
PubChem CID562619
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name1-benzylimidazolidine-2,4,5-trione
SMILESO=C1NC(=O)N(Cc2ccccc2)C1=O
InChIInChI=1S/C10H8N2O3/c13-8-9(14)12(10(15)11-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,13,15)
InChIKeyGGLAGGHAVVZWSQ-UHFFFAOYSA-N
XLogP0.26
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-benzylimidazolidine-2,4,5-trione 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

Ethotoin
CID 3292
Mephenytoin
CID 4060
Tdzd-8
CID 4124851
Mephenytoin, (+)-
CID 107921
Phenylhydantoin
CID 1002
3-benzyl-6-chloro-1H-pyrimidine-2,4-dione
CID 937941
Methetoin
CID 21908
6-Amino-1-benzyl-5-(ethylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2392273
2,4-Imidazolidinedione, 5-ethoxy-1-(phenylmethyl)-
CID 4079622
2-(2,5-Dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 2107999
Acetamide, N-benzyl-2-(1-pyrrolidinyl)-, hydrochloride
CID 2959243
2,4-Imidazolidinedione, 3-(phenylmethyl)-
CID 231959

Frequently Asked Questions

What is the IUPAC name of 1-benzylimidazolidine-2,4,5-trione?
The IUPAC name of 1-benzylimidazolidine-2,4,5-trione (CID 562619) is 1-benzylimidazolidine-2,4,5-trione.
What is the SMILES notation for 1-benzylimidazolidine-2,4,5-trione?
The canonical SMILES for 1-benzylimidazolidine-2,4,5-trione is O=C1NC(=O)N(Cc2ccccc2)C1=O.
What is the InChIKey of 1-benzylimidazolidine-2,4,5-trione?
The InChIKey is GGLAGGHAVVZWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c13-8-9(14)12(10(15)11-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,13,15).
What are the key properties of 1-benzylimidazolidine-2,4,5-trione?
1-benzylimidazolidine-2,4,5-trione has a molecular weight of 204.19 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylimidazolidine-2,4,5-trione is sourced from PubChem (CID 562619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).