3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione

C11H21N3O2 — CID 3028666

IUPAC3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN(CC)CCN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C11H21N3O2/c1-5-13(6-2)7-8-14-9(15)11(3,4)12-10(14)16/h5-8H2,1-4H3,(H,12,16)
InChIKeyRBGDCILNUYNUQQ-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.66
Rot. Bonds5

About 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione

3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 3028666) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID3028666
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN(CC)CCN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C11H21N3O2/c1-5-13(6-2)7-8-14-9(15)11(3,4)12-10(14)16/h5-8H2,1-4H3,(H,12,16)
InChIKeyRBGDCILNUYNUQQ-UHFFFAOYSA-N
XLogP0.66
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione (CID 3028666) is 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione is CCN(CC)CCN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is RBGDCILNUYNUQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-5-13(6-2)7-8-14-9(15)11(3,4)12-10(14)16/h5-8H2,1-4H3,(H,12,16).
What are the key properties of 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 227.31 g/mol, XLogP of 0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(diethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 3028666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).