3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione

C10H19N3O2 — CID 4737450

IUPAC3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN(CC)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C10H19N3O2/c1-5-12(6-2)7-13-8(14)10(3,4)11-9(13)15/h5-7H2,1-4H3,(H,11,15)
InChIKeyWSDCFMIUFDDKHH-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.62
Rot. Bonds4

About 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione

3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 4737450) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione
PubChem CID4737450
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN(CC)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C10H19N3O2/c1-5-12(6-2)7-13-8(14)10(3,4)11-9(13)15/h5-7H2,1-4H3,(H,11,15)
InChIKeyWSDCFMIUFDDKHH-UHFFFAOYSA-N
XLogP0.62
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2-Hydroxyethyl)-5,5-dimethylhydantoin
CID 99605
1,5,5-Trimethylimidazolidine-2,4-dione
CID 81295
2,4-Imidazolidinedione, 3-(hydroxymethyl)-5,5-dimethyl-
CID 85341
3,5,5-Trimethylimidazolidine-2,4-dione
CID 237560
3,5-Dimethyl-2,4-Imidazolidinedione
CID 10154061
5,5-Dimethyl-3-(piperazin-1-ylmethyl)imidazolidine-2,4-dione
CID 6501454
3,3'-Methylenebis(5,5-dimethylimidazolidine-2,4-dione)
CID 226793
Hydantoin, 3,3'-(1,4-piperazinediyldimethylene)bis(5,5-dimethyl-
CID 98587
1-Propylimidazolidine-2,4,5-trione
CID 181667
3-Ethyl-5,5-dimethylimidazolidine-2,4-dione
CID 588189
2,4-Imidazolidinedione, 5,5-dimethyl-3-[3-(triethoxysilyl)propyl]-
CID 46179117
N-[1-butyl-2,5-dioxo-4-(trifluoromethyl)-4-imidazolidinyl]acetamide
CID 2968525

Frequently Asked Questions

What is the IUPAC name of 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione (CID 4737450) is 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione is CCN(CC)CN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is WSDCFMIUFDDKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-5-12(6-2)7-13-8(14)10(3,4)11-9(13)15/h5-7H2,1-4H3,(H,11,15).
What are the key properties of 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione?
3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 213.28 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylaminomethyl)-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 4737450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).