5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione

C8H16N2O5Si — CID 22274835

IUPAC5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione
SMILESCC1(C)C(=O)NC(=O)N1CCC[Si](O)(O)O
InChIInChI=1S/C8H16N2O5Si/c1-8(2)6(11)9-7(12)10(8)4-3-5-16(13,14)15/h13-15H,3-5H2,1-2H3,(H,9,11,12)
InChIKeyNRZXDDKTBKWZMC-UHFFFAOYSA-N
MW248.31 g/mol
LogP-1.38
Rot. Bonds4

About 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione

5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione (PubChem CID 22274835) has the molecular formula C8H16N2O5Si and a molecular weight of 248.31 g/mol. Its IUPAC name is 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione
PubChem CID22274835
Molecular FormulaC8H16N2O5Si
Molecular Weight248.31 g/mol
Exact Mass248.08
IUPAC Name5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione
SMILESCC1(C)C(=O)NC(=O)N1CCC[Si](O)(O)O
InChIInChI=1S/C8H16N2O5Si/c1-8(2)6(11)9-7(12)10(8)4-3-5-16(13,14)15/h13-15H,3-5H2,1-2H3,(H,9,11,12)
InChIKeyNRZXDDKTBKWZMC-UHFFFAOYSA-N
XLogP-1.38
TPSA110.10 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 5-1.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione (CID 22274835) is 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione is CC1(C)C(=O)NC(=O)N1CCC[Si](O)(O)O.
What is the InChIKey of 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione?
The InChIKey is NRZXDDKTBKWZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O5Si/c1-8(2)6(11)9-7(12)10(8)4-3-5-16(13,14)15/h13-15H,3-5H2,1-2H3,(H,9,11,12).
What are the key properties of 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione?
5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione has a molecular weight of 248.31 g/mol, XLogP of -1.38, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1-(3-trihydroxysilylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 22274835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).