3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione

C10H16N4O2 — CID 146519519

IUPAC3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(CCN2C=CNC2)C1=O
InChIInChI=1S/C10H16N4O2/c1-10(2)8(15)14(9(16)12-10)6-5-13-4-3-11-7-13/h3-4,11H,5-7H2,1-2H3,(H,12,16)
InChIKeyZYHXCKKUSWXIRX-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.35
Rot. Bonds3

About 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione

3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 146519519) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID146519519
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(CCN2C=CNC2)C1=O
InChIInChI=1S/C10H16N4O2/c1-10(2)8(15)14(9(16)12-10)6-5-13-4-3-11-7-13/h3-4,11H,5-7H2,1-2H3,(H,12,16)
InChIKeyZYHXCKKUSWXIRX-UHFFFAOYSA-N
XLogP-0.35
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-aminoethyl)-5,5-dimethylimidazolidine-2,4-dione;hydrochloride
CID 14008501
3-(2-fluoroethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 131132087
3-(bromomethyl)-5,5-dimethylimidazolidine-2,4-dione
CID 12847944
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanal
CID 63040568
3-[2-(4-aminopiperidin-1-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 43556669
3-[2-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 63309791
3-[2-(ethylamino)ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 61387578
5,5-dimethyl-3-[2-(4-phenylpiperidin-1-yl)ethyl]imidazolidine-2,4-dione
CID 56811818
3-[2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 94393094
3-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 43259753
5-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)pentanoic acid
CID 28971868
5,5-dimethyl-3-[2-(propylamino)ethyl]imidazolidine-2,4-dione
CID 61387575

Frequently Asked Questions

What is the IUPAC name of 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione (CID 146519519) is 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione is CC1(C)NC(=O)N(CCN2C=CNC2)C1=O.
What is the InChIKey of 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is ZYHXCKKUSWXIRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-10(2)8(15)14(9(16)12-10)6-5-13-4-3-11-7-13/h3-4,11H,5-7H2,1-2H3,(H,12,16).
What are the key properties of 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 224.26 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1,2-dihydroimidazol-3-yl)ethyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 146519519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).