5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione

C12H18N2O4 — CID 27204

IUPAC5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione
SMILESCCC1(C)C(=O)N(CC2CO2)C(=O)N1CC1CO1
InChIInChI=1S/C12H18N2O4/c1-3-12(2)10(15)13(4-8-6-17-8)11(16)14(12)5-9-7-18-9/h8-9H,3-7H2,1-2H3
InChIKeyJBBURRWEMSTGIX-UHFFFAOYSA-N
MW254.29 g/mol
LogP0.22
Rot. Bonds5

About 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione

5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione (PubChem CID 27204) has the molecular formula C12H18N2O4 and a molecular weight of 254.29 g/mol. Its IUPAC name is 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione
PubChem CID27204
Molecular FormulaC12H18N2O4
Molecular Weight254.29 g/mol
Exact Mass254.13
IUPAC Name5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione
SMILESCCC1(C)C(=O)N(CC2CO2)C(=O)N1CC1CO1
InChIInChI=1S/C12H18N2O4/c1-3-12(2)10(15)13(4-8-6-17-8)11(16)14(12)5-9-7-18-9/h8-9H,3-7H2,1-2H3
InChIKeyJBBURRWEMSTGIX-UHFFFAOYSA-N
XLogP0.22
TPSA65.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,4-Imidazolidinedione, 5,5-dimethyl-3-[2-(2-oxiranylmethoxy)propyl]-1-(2-oxiranylmethyl)-
CID 61911
2,4-Imidazolidinedione, 5,5-dimethyl-1,3-bis(2-oxiranylmethyl)-
CID 85828
5-Ethyl-5-(2-methylbutyl)-1,3-bis(oxiranylmethyl)imidazolidine-2,4-dione
CID 92378
1,1'-Methylene-bis[3-glycidyl-5,5-dimethylhydantoin]
CID 4363652
5,5-Dimethyl-1-(oxiran-2-ylmethyl)-3-propylimidazolidine-2,4-dione
CID 18388502
3-[2,3-Bis(oxiran-2-ylmethoxy)propyl]-5,5-dimethyl-1-(oxiran-2-ylmethyl)imidazolidine-2,4-dione
CID 19800385
5,5-Dimethyl-1,3-bis[2-(oxiran-2-ylmethoxy)ethyl]imidazolidine-2,4-dione
CID 20283488
5-Hexyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione
CID 20283492
1,3-Bis(oxiran-2-ylmethyl)-5-pentylimidazolidine-2,4-dione
CID 20283493
5-Methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione
CID 20283494
3-(2-Ethenoxyethyl)-5,5-dimethyl-1-(oxiran-2-ylmethyl)imidazolidine-2,4-dione
CID 20285621
5-Heptyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione
CID 20333194

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione (CID 27204) is 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione is CCC1(C)C(=O)N(CC2CO2)C(=O)N1CC1CO1.
What is the InChIKey of 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is JBBURRWEMSTGIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4/c1-3-12(2)10(15)13(4-8-6-17-8)11(16)14(12)5-9-7-18-9/h8-9H,3-7H2,1-2H3.
What are the key properties of 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione?
5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 254.29 g/mol, XLogP of 0.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methyl-1,3-bis(oxiran-2-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 27204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).