1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione

C29H32N2O2Si — CID 140848489

IUPAC1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione
SMILESCCC1C(=O)N([Si](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)N1C1CCCCC1
InChIInChI=1S/C29H32N2O2Si/c1-2-27-28(32)31(29(33)30(27)23-15-7-3-8-16-23)34(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h4-6,9-14,17-23,27H,2-3,7-8,15-16H2,1H3
InChIKeyQXZLZFDWNGDYHK-UHFFFAOYSA-N
MW468.67 g/mol
LogP4.03
Rot. Bonds6

About 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione

1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione (PubChem CID 140848489) has the molecular formula C29H32N2O2Si and a molecular weight of 468.67 g/mol. Its IUPAC name is 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione
PubChem CID140848489
Molecular FormulaC29H32N2O2Si
Molecular Weight468.67 g/mol
Exact Mass468.22
IUPAC Name1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione
SMILESCCC1C(=O)N([Si](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)N1C1CCCCC1
InChIInChI=1S/C29H32N2O2Si/c1-2-27-28(32)31(29(33)30(27)23-15-7-3-8-16-23)34(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h4-6,9-14,17-23,27H,2-3,7-8,15-16H2,1H3
InChIKeyQXZLZFDWNGDYHK-UHFFFAOYSA-N
XLogP4.03
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.67
LogP ≤ 54.03
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'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione?
The IUPAC name of 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione (CID 140848489) is 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione.
What is the SMILES notation for 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione?
The canonical SMILES for 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione is CCC1C(=O)N([Si](c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)N1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione?
The InChIKey is QXZLZFDWNGDYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32N2O2Si/c1-2-27-28(32)31(29(33)30(27)23-15-7-3-8-16-23)34(24-17-9-4-10-18-24,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h4-6,9-14,17-23,27H,2-3,7-8,15-16H2,1H3.
What are the key properties of 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione?
1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione has a molecular weight of 468.67 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-5-ethyl-3-triphenylsilylimidazolidine-2,4-dione is sourced from PubChem (CID 140848489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).