3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione

C15H14FN3O3 — CID 16661082

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
SMILESCc1noc(C)c1N1C(=O)NC(Cc2ccc(F)cc2)C1=O
InChIInChI=1S/C15H14FN3O3/c1-8-13(9(2)22-18-8)19-14(20)12(17-15(19)21)7-10-3-5-11(16)6-4-10/h3-6,12H,7H2,1-2H3,(H,17,21)
InChIKeyHHKYTMMZOFQGFQ-UHFFFAOYSA-N
MW303.29 g/mol
LogP2.10
Rot. Bonds3

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione

3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione (PubChem CID 16661082) has the molecular formula C15H14FN3O3 and a molecular weight of 303.29 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
PubChem CID16661082
Molecular FormulaC15H14FN3O3
Molecular Weight303.29 g/mol
Exact Mass303.10
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
SMILESCc1noc(C)c1N1C(=O)NC(Cc2ccc(F)cc2)C1=O
InChIInChI=1S/C15H14FN3O3/c1-8-13(9(2)22-18-8)19-14(20)12(17-15(19)21)7-10-3-5-11(16)6-4-10/h3-6,12H,7H2,1-2H3,(H,17,21)
InChIKeyHHKYTMMZOFQGFQ-UHFFFAOYSA-N
XLogP2.10
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-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-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione (CID 16661082) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione is Cc1noc(C)c1N1C(=O)NC(Cc2ccc(F)cc2)C1=O.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
The InChIKey is HHKYTMMZOFQGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O3/c1-8-13(9(2)22-18-8)19-14(20)12(17-15(19)21)7-10-3-5-11(16)6-4-10/h3-6,12H,7H2,1-2H3,(H,17,21).
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione has a molecular weight of 303.29 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 16661082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).