3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione

C8H15N3O2 — CID 167168232

IUPAC3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione
SMILESCN(C)CCN1C(=O)CN(C)C1=O
InChIInChI=1S/C8H15N3O2/c1-9(2)4-5-11-7(12)6-10(3)8(11)13/h4-6H2,1-3H3
InChIKeyMZLLSSWCAVUOND-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.56
Rot. Bonds3

About 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione

3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione (PubChem CID 167168232) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione
PubChem CID167168232
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione
SMILESCN(C)CCN1C(=O)CN(C)C1=O
InChIInChI=1S/C8H15N3O2/c1-9(2)4-5-11-7(12)6-10(3)8(11)13/h4-6H2,1-3H3
InChIKeyMZLLSSWCAVUOND-UHFFFAOYSA-N
XLogP-0.56
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.56
H-Bond Donors ≤ 50
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-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione (CID 167168232) is 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione is CN(C)CCN1C(=O)CN(C)C1=O.
What is the InChIKey of 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione?
The InChIKey is MZLLSSWCAVUOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-9(2)4-5-11-7(12)6-10(3)8(11)13/h4-6H2,1-3H3.
What are the key properties of 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione?
3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione has a molecular weight of 185.23 g/mol, XLogP of -0.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethyl]-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 167168232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).