1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione

C18H36N2O2Si — CID 140848638

IUPAC1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione
SMILESCCC[Si](CCC)(CCC)N1C(=O)N(CC)C(CC)(CC)C1=O
InChIInChI=1S/C18H36N2O2Si/c1-7-13-23(14-8-2,15-9-3)20-16(21)18(10-4,11-5)19(12-6)17(20)22/h7-15H2,1-6H3
InChIKeyJPXGKHAWWTYSCV-UHFFFAOYSA-N
MW340.58 g/mol
LogP5.00
Rot. Bonds10

About 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione

1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione (PubChem CID 140848638) has the molecular formula C18H36N2O2Si and a molecular weight of 340.58 g/mol. Its IUPAC name is 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione
PubChem CID140848638
Molecular FormulaC18H36N2O2Si
Molecular Weight340.58 g/mol
Exact Mass340.25
IUPAC Name1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione
SMILESCCC[Si](CCC)(CCC)N1C(=O)N(CC)C(CC)(CC)C1=O
InChIInChI=1S/C18H36N2O2Si/c1-7-13-23(14-8-2,15-9-3)20-16(21)18(10-4,11-5)19(12-6)17(20)22/h7-15H2,1-6H3
InChIKeyJPXGKHAWWTYSCV-UHFFFAOYSA-N
XLogP5.00
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.58
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione?
The IUPAC name of 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione (CID 140848638) is 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione.
What is the SMILES notation for 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione?
The canonical SMILES for 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione is CCC[Si](CCC)(CCC)N1C(=O)N(CC)C(CC)(CC)C1=O.
What is the InChIKey of 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione?
The InChIKey is JPXGKHAWWTYSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O2Si/c1-7-13-23(14-8-2,15-9-3)20-16(21)18(10-4,11-5)19(12-6)17(20)22/h7-15H2,1-6H3.
What are the key properties of 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione?
1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione has a molecular weight of 340.58 g/mol, XLogP of 5.00, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5-triethyl-3-tripropylsilylimidazolidine-2,4-dione is sourced from PubChem (CID 140848638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).