1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione

C15H9F2N3O2 — CID 134088027

IUPAC1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione
SMILES[H]/N=C1\C(=O)N(c2ccccc2)C(=O)N1c1ccc(F)c(F)c1
InChIInChI=1S/C15H9F2N3O2/c16-11-7-6-10(8-12(11)17)19-13(18)14(21)20(15(19)22)9-4-2-1-3-5-9/h1-8,18H/b18-13+
InChIKeyKVKGVDVJGOMHRT-QGOAFFKASA-N
MW301.25 g/mol
LogP2.92
Rot. Bonds2

About 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione

1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione (PubChem CID 134088027) has the molecular formula C15H9F2N3O2 and a molecular weight of 301.25 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione
PubChem CID134088027
Molecular FormulaC15H9F2N3O2
Molecular Weight301.25 g/mol
Exact Mass301.07
IUPAC Name1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione
SMILES[H]/N=C1\C(=O)N(c2ccccc2)C(=O)N1c1ccc(F)c(F)c1
InChIInChI=1S/C15H9F2N3O2/c16-11-7-6-10(8-12(11)17)19-13(18)14(21)20(15(19)22)9-4-2-1-3-5-9/h1-8,18H/b18-13+
InChIKeyKVKGVDVJGOMHRT-QGOAFFKASA-N
XLogP2.92
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.25
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-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

Related Compounds

1-(4-chlorophenyl)-5-imino-3-phenyl-4-sulfanylideneimidazolidin-2-one
CID 12774190
1,3-diphenyl-1,3-diazinane-2,4,5,6-tetrone
CID 22323521
3,4-difluoro-1-phenylpyrrole-2,5-dione
CID 13059269
3-(4-chlorophenyl)sulfanyl-1-(3,4-difluorophenyl)-4-phenylpyrrole-2,5-dione
CID 110562040
5-imino-4,4-dimethyl-1-phenylimidazolidin-2-one
CID 35140530
1-(4-chlorophenyl)sulfonyl-5-imino-3-phenyl-4-sulfanylideneimidazolidin-2-one
CID 134088022
5-[(3-fluorophenyl)methylidene]-1,3-diphenyl-1,3-diazinane-2,4,6-trione
CID 19166951
1-(3,4-difluorophenyl)-3-(2,3-dihydroindol-1-yl)-4-phenylpyrrole-2,5-dione
CID 110562035
2-(5,6-difluoro-1,3-diphenylbenzimidazol-2-ylidene)-5,6-difluoro-1,3-diphenylbenzimidazole
CID 129174928
4-(3H-1,3-benzothiazol-2-ylidene)-1-(3-chloro-4-fluorophenyl)-5-iminopyrrolidin-2-one
CID 135508308
5-[1-imino-3-oxo-2-(4-phenoxyphenyl)isoindol-5-yl]oxy-2-(4-phenoxyphenyl)isoindole-1,3-dione
CID 123289566
3-(4-chlorophenyl)-1-(3,4-difluorophenyl)pyrrole-2,5-dione
CID 24952429

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione?
The IUPAC name of 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione (CID 134088027) is 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione?
The canonical SMILES for 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione is [H]/N=C1\C(=O)N(c2ccccc2)C(=O)N1c1ccc(F)c(F)c1.
What is the InChIKey of 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione?
The InChIKey is KVKGVDVJGOMHRT-QGOAFFKASA-N. The full InChI is InChI=1S/C15H9F2N3O2/c16-11-7-6-10(8-12(11)17)19-13(18)14(21)20(15(19)22)9-4-2-1-3-5-9/h1-8,18H/b18-13+.
What are the key properties of 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione?
1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione has a molecular weight of 301.25 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-difluorophenyl)-5-imino-3-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 134088027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).