1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one

C6H12Cl2N2O2Si — CID 166544697

IUPAC1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one
SMILESO=C1NCCN1CCC[Si](O)(Cl)Cl
InChIInChI=1S/C6H12Cl2N2O2Si/c7-13(8,12)5-1-3-10-4-2-9-6(10)11/h12H,1-5H2,(H,9,11)
InChIKeyAUPBLUFADLUNBR-UHFFFAOYSA-N
MW243.17 g/mol
LogP0.81
Rot. Bonds4

About 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one

1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one (PubChem CID 166544697) has the molecular formula C6H12Cl2N2O2Si and a molecular weight of 243.17 g/mol. Its IUPAC name is 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one
PubChem CID166544697
Molecular FormulaC6H12Cl2N2O2Si
Molecular Weight243.17 g/mol
Exact Mass242.00
IUPAC Name1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one
SMILESO=C1NCCN1CCC[Si](O)(Cl)Cl
InChIInChI=1S/C6H12Cl2N2O2Si/c7-13(8,12)5-1-3-10-4-2-9-6(10)11/h12H,1-5H2,(H,9,11)
InChIKeyAUPBLUFADLUNBR-UHFFFAOYSA-N
XLogP0.81
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.17
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one?
The IUPAC name of 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one (CID 166544697) is 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one.
What is the SMILES notation for 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one?
The canonical SMILES for 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one is O=C1NCCN1CCC[Si](O)(Cl)Cl.
What is the InChIKey of 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one?
The InChIKey is AUPBLUFADLUNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12Cl2N2O2Si/c7-13(8,12)5-1-3-10-4-2-9-6(10)11/h12H,1-5H2,(H,9,11).
What are the key properties of 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one?
1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one has a molecular weight of 243.17 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[dichloro(hydroxy)silyl]propyl]imidazolidin-2-one is sourced from PubChem (CID 166544697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).