CID 176550814

C8H19O2Si — CID 176550814

IUPAC
SMILESCCO[Si](CC)OCC(C)C
InChIInChI=1S/C8H19O2Si/c1-5-9-11(6-2)10-7-8(3)4/h8H,5-7H2,1-4H3
InChIKeyDGDGENVFVXYYTJ-UHFFFAOYSA-N
MW175.32 g/mol
LogP2.20
Rot. Bonds6

About CID 176550814

CID 176550814 (PubChem CID 176550814) has the molecular formula C8H19O2Si and a molecular weight of 175.32 g/mol.

Molecular Properties

Compound NameCID 176550814
PubChem CID176550814
Molecular FormulaC8H19O2Si
Molecular Weight175.32 g/mol
Exact Mass175.12
IUPAC Name
SMILESCCO[Si](CC)OCC(C)C
InChIInChI=1S/C8H19O2Si/c1-5-9-11(6-2)10-7-8(3)4/h8H,5-7H2,1-4H3
InChIKeyDGDGENVFVXYYTJ-UHFFFAOYSA-N
XLogP2.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.32
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze CID 176550814 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 CID 176550814?
The IUPAC name of CID 176550814 (CID 176550814) is not available.
What is the SMILES notation for CID 176550814?
The canonical SMILES for CID 176550814 is CCO[Si](CC)OCC(C)C.
What is the InChIKey of CID 176550814?
The InChIKey is DGDGENVFVXYYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19O2Si/c1-5-9-11(6-2)10-7-8(3)4/h8H,5-7H2,1-4H3.
What are the key properties of CID 176550814?
CID 176550814 has a molecular weight of 175.32 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 176550814 is sourced from PubChem (CID 176550814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).