3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione

C10H9FN2O2 — CID 835217

IUPAC3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1Cc1ccc(F)cc1
InChIInChI=1S/C10H9FN2O2/c11-8-3-1-7(2-4-8)6-13-9(14)5-12-10(13)15/h1-4H,5-6H2,(H,12,15)
InChIKeyQMZYSCSWNDPNIM-UHFFFAOYSA-N
MW208.19 g/mol
LogP0.88
Rot. Bonds2

About 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione

3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione (PubChem CID 835217) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
PubChem CID835217
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1Cc1ccc(F)cc1
InChIInChI=1S/C10H9FN2O2/c11-8-3-1-7(2-4-8)6-13-9(14)5-12-10(13)15/h1-4H,5-6H2,(H,12,15)
InChIKeyQMZYSCSWNDPNIM-UHFFFAOYSA-N
XLogP0.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Ethotoin
CID 3292
Phenylhydantoin
CID 1002
6-Amino-1-benzyl-5-(ethylamino)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2392273
1-Benzylimidazolidine-2,4,5-trione
CID 562619
Acetamide, N-benzyl-2-(1-pyrrolidinyl)-, hydrochloride
CID 2959243
2,4-Imidazolidinedione, 3-(phenylmethyl)-
CID 231959
6-Amino-5-benzylamino-1-butyl-1H-pyrimidine-2,4-dione
CID 2341173
1-Benzylimidazolidin-2-one
CID 231403
5-(Benzylamino)pyrimidine-2,4(1h,3h)-dione
CID 273579
6-Amino-1-benzyl-5-methylaminouracil
CID 726225
1-Pyrrolidineacetamide, N-[(2-fluorophenyl)methyl]-|A-methyl-2,5-dioxo-, (|AR)-
CID 155213179
N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]pentanamide
CID 4264496

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione (CID 835217) is 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione is O=C1CNC(=O)N1Cc1ccc(F)cc1.
What is the InChIKey of 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
The InChIKey is QMZYSCSWNDPNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c11-8-3-1-7(2-4-8)6-13-9(14)5-12-10(13)15/h1-4H,5-6H2,(H,12,15).
What are the key properties of 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione?
3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione has a molecular weight of 208.19 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 835217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).