3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione

C6H9FN2O2 — CID 127013693

IUPAC3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione
SMILESCN1CC(=O)N(CCF)C1=O
InChIInChI=1S/C6H9FN2O2/c1-8-4-5(10)9(3-2-7)6(8)11/h2-4H2,1H3
InChIKeyGTHGSEJSEBKYOO-UHFFFAOYSA-N
MW160.15 g/mol
LogP-0.15
Rot. Bonds2

About 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione

3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione (PubChem CID 127013693) has the molecular formula C6H9FN2O2 and a molecular weight of 160.15 g/mol. Its IUPAC name is 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione
PubChem CID127013693
Molecular FormulaC6H9FN2O2
Molecular Weight160.15 g/mol
Exact Mass160.06
IUPAC Name3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione
SMILESCN1CC(=O)N(CCF)C1=O
InChIInChI=1S/C6H9FN2O2/c1-8-4-5(10)9(3-2-7)6(8)11/h2-4H2,1H3
InChIKeyGTHGSEJSEBKYOO-UHFFFAOYSA-N
XLogP-0.15
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.15
LogP ≤ 5-0.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-(2-fluoroethyl)-1-methylimidazolidine-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

ethane;3-ethyl-1-methylimidazolidine-2,4-dione
CID 142101907
3-(3-bromopropyl)-1-methylimidazolidine-2,4-dione
CID 43135403
3-(3-chloropropyl)-1-methylimidazolidine-2,4-dione
CID 28824124
3-(3-amino-3-methylbutyl)-1-methylimidazolidine-2,4-dione
CID 83819144
3-(2-hydroxy-2-methylpropyl)-1-methylimidazolidine-2,4-dione
CID 83817541
methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione
CID 160883463
3-[2-(2,2-dimethylpropoxy)ethyl]-1-methylimidazolidine-2,4-dione
CID 21027116
1-methyl-3-(4-oxohexyl)imidazolidine-2,4-dione
CID 106801687
1-methyl-3-[(2-methylcyclopropyl)methyl]imidazolidine-2,4-dione
CID 130666724
ethyl 3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanoate
CID 43242890
3-(isothiocyanatomethyl)-1-methylimidazolidine-2,4-dione
CID 154115879
2,2-dimethyl-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanethioamide
CID 65248880

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione?
The IUPAC name of 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione (CID 127013693) is 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione is CN1CC(=O)N(CCF)C1=O.
What is the InChIKey of 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione?
The InChIKey is GTHGSEJSEBKYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2O2/c1-8-4-5(10)9(3-2-7)6(8)11/h2-4H2,1H3.
What are the key properties of 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione?
3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione has a molecular weight of 160.15 g/mol, XLogP of -0.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethyl)-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 127013693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).