5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione

C10H19N3O2 — CID 61387575

IUPAC5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione
SMILESCCCNCCN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C10H19N3O2/c1-4-5-11-6-7-13-8(14)10(2,3)12-9(13)15/h11H,4-7H2,1-3H3,(H,12,15)
InChIKeyVBPXBMHKFYTOSL-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.32
Rot. Bonds5

About 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione

5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione (PubChem CID 61387575) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione
PubChem CID61387575
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione
SMILESCCCNCCN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C10H19N3O2/c1-4-5-11-6-7-13-8(14)10(2,3)12-9(13)15/h11H,4-7H2,1-3H3,(H,12,15)
InChIKeyVBPXBMHKFYTOSL-UHFFFAOYSA-N
XLogP0.32
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(ethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 61387578
3-[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethylamino]propanoic acid
CID 43466330
5,5-dimethyl-3-[2-(3-triethoxysilylpropylamino)ethyl]imidazolidine-2,4-dione
CID 69250773
6-[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethylamino]-4-methylhexanoic acid
CID 65289762
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanal
CID 63040568
3-(2-fluoroethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 131132087
3,3,5,5-tetramethyl-1-[2-(propylamino)ethyl]piperazin-2-one
CID 67926945
3-(2-aminoethyl)-5,5-dimethylimidazolidine-2,4-dione;hydrochloride
CID 14008501
butyl-[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethyl]-dimethylazanium
CID 158812623
3-[2-[(2,6-dimethylcyclohexyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 75444192
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide
CID 60656567
3-(bromomethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 12847944

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione (CID 61387575) is 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione is CCCNCCN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione?
The InChIKey is VBPXBMHKFYTOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-4-5-11-6-7-13-8(14)10(2,3)12-9(13)15/h11H,4-7H2,1-3H3,(H,12,15).
What are the key properties of 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione?
5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione has a molecular weight of 213.28 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 61387575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).