5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione

C12H13FN2O2 — CID 141409272

IUPAC5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione
SMILESCC1(CCc2ccccc2F)NC(=O)NC1=O
InChIInChI=1S/C12H13FN2O2/c1-12(10(16)14-11(17)15-12)7-6-8-4-2-3-5-9(8)13/h2-5H,6-7H2,1H3,(H2,14,15,16,17)
InChIKeyULQJEBQHDYGXDF-UHFFFAOYSA-N
MW236.25 g/mol
LogP1.36
Rot. Bonds3

About 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione

5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione (PubChem CID 141409272) has the molecular formula C12H13FN2O2 and a molecular weight of 236.25 g/mol. Its IUPAC name is 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione
PubChem CID141409272
Molecular FormulaC12H13FN2O2
Molecular Weight236.25 g/mol
Exact Mass236.10
IUPAC Name5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione
SMILESCC1(CCc2ccccc2F)NC(=O)NC1=O
InChIInChI=1S/C12H13FN2O2/c1-12(10(16)14-11(17)15-12)7-6-8-4-2-3-5-9(8)13/h2-5H,6-7H2,1H3,(H2,14,15,16,17)
InChIKeyULQJEBQHDYGXDF-UHFFFAOYSA-N
XLogP1.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(5S)-5-[2-(2-bromophenyl)ethyl]-5-methylimidazolidine-2,4-dione
CID 124672916
5-[2-(3-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione
CID 141409275
2-[4-[2-(2-fluorophenyl)ethyl]-2,5-dioxoimidazolidin-4-yl]cyclopropane-1-carboxylic acid
CID 19702158
2-ethylimino-5-[(2-fluorophenyl)methyl]-5-methylimidazolidin-4-one
CID 136994576
5-[2-(4-bromophenyl)ethyl]-5-methylimidazolidine-2,4-dione;5-methyl-5-[2-[4-(2-phenylethynyl)phenyl]ethyl]imidazolidine-2,4-dione
CID 158732289
1-[2-(2-fluorophenyl)ethyl]-3-methylpiperazine-2,5-dione
CID 64956982
1-[2-(2-fluorophenyl)ethyl]-1,3-diazinane-2,4-dione
CID 79778174
3-(2-fluorophenyl)propanoic acid
CID 2063866
(5R)-5-[3-[(3R)-3-[(2-fluorophenoxy)methyl]piperidin-1-yl]-3-oxopropyl]-5-methylimidazolidine-2,4-dione
CID 92582884
azane;1-ethyl-2-fluorobenzene
CID 66657049
6-ethyl-1-[(2-fluorophenyl)methyl]-3,3,6-trimethylpiperazine-2,5-dione
CID 64902761
4-(2-fluorophenyl)butan-2-ol
CID 12618518

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione (CID 141409272) is 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione is CC1(CCc2ccccc2F)NC(=O)NC1=O.
What is the InChIKey of 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione?
The InChIKey is ULQJEBQHDYGXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O2/c1-12(10(16)14-11(17)15-12)7-6-8-4-2-3-5-9(8)13/h2-5H,6-7H2,1H3,(H2,14,15,16,17).
What are the key properties of 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione?
5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 236.25 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-fluorophenyl)ethyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 141409272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).