3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione

C7H11ClN2O2 — CID 141201222

IUPAC3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN1C(=O)N(Cl)C(=O)C1(C)C
InChIInChI=1S/C7H11ClN2O2/c1-4-9-6(12)10(8)5(11)7(9,2)3/h4H2,1-3H3
InChIKeyRAODKEBJHXBBAZ-UHFFFAOYSA-N
MW190.63 g/mol
LogP1.20
Rot. Bonds1

About 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione

3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 141201222) has the molecular formula C7H11ClN2O2 and a molecular weight of 190.63 g/mol. Its IUPAC name is 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione
PubChem CID141201222
Molecular FormulaC7H11ClN2O2
Molecular Weight190.63 g/mol
Exact Mass190.05
IUPAC Name3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN1C(=O)N(Cl)C(=O)C1(C)C
InChIInChI=1S/C7H11ClN2O2/c1-4-9-6(12)10(8)5(11)7(9,2)3/h4H2,1-3H3
InChIKeyRAODKEBJHXBBAZ-UHFFFAOYSA-N
XLogP1.20
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.63
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-chloro-1-ethyl-5,5-dimethylimidazolidine-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-ethyl-5,5-dimethyl-3-triphenylsilylimidazolidine-2,4-dione
CID 140848579
1,3-dichloro-5-ethyl-5-propylimidazolidine-2,4-dione
CID 54230615
5,5-dibutyl-1,3-dichloroimidazolidine-2,4-dione
CID 22351148
1,3-dichloro-5,5-dimethylimidazolidine-2,4-dione;iodobenzene;dihydrochloride
CID 172795811
1,3-bis(ethoxymethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 118434025
3,5-diethyl-5-methyl-1,3-oxazolidin-2-one
CID 22000696
3-(2,6-dimethylphenyl)-1-ethyl-5,5-dimethyl-2-sulfanylideneimidazolidin-4-one
CID 11334881
1,3-bis(dimethylphosphorylmethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 164745943
1-ethyl-6,6-dimethylpiperazine-2,5-dione
CID 64879711
9-ethyl-8,8-dimethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886492
5,5-dimethyl-3-[4-(2,2,2-trifluoroethyl)phenyl]imidazolidine-2,4-dione;1-ethyl-5,5-dimethyl-3-[4-(2,2,2-trifluoroethyl)phenyl]imidazolidine-2,4-dione;propane
CID 161410166
1-ethyl-2,2-dimethylimidazolidine-4,5-dione
CID 58353459

Frequently Asked Questions

What is the IUPAC name of 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione (CID 141201222) is 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione is CCN1C(=O)N(Cl)C(=O)C1(C)C.
What is the InChIKey of 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is RAODKEBJHXBBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11ClN2O2/c1-4-9-6(12)10(8)5(11)7(9,2)3/h4H2,1-3H3.
What are the key properties of 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione?
3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 190.63 g/mol, XLogP of 1.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-1-ethyl-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 141201222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).