CID 53400370

C7H15O2Si — CID 53400370

IUPAC—
SMILESCC=C[Si](OCC)OCC
InChIInChI=1S/C7H15O2Si/c1-4-7-10(8-5-2)9-6-3/h4,7H,5-6H2,1-3H3
InChIKeyRGAAWXHMUYEVCL-UHFFFAOYSA-N
MW159.28 g/mol
LogP1.66
Rot. Bonds5

About CID 53400370

CID 53400370 (PubChem CID 53400370) has the molecular formula C7H15O2Si and a molecular weight of 159.28 g/mol.

Molecular Properties

Compound NameCID 53400370
PubChem CID53400370
Molecular FormulaC7H15O2Si
Molecular Weight159.28 g/mol
Exact Mass159.08
IUPAC Name—
SMILESCC=C[Si](OCC)OCC
InChIInChI=1S/C7H15O2Si/c1-4-7-10(8-5-2)9-6-3/h4,7H,5-6H2,1-3H3
InChIKeyRGAAWXHMUYEVCL-UHFFFAOYSA-N
XLogP1.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.28
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze CID 53400370 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 53400370?
The IUPAC name of CID 53400370 (CID 53400370) is not available.
What is the SMILES notation for CID 53400370?
The canonical SMILES for CID 53400370 is CC=C[Si](OCC)OCC.
What is the InChIKey of CID 53400370?
The InChIKey is RGAAWXHMUYEVCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15O2Si/c1-4-7-10(8-5-2)9-6-3/h4,7H,5-6H2,1-3H3.
What are the key properties of CID 53400370?
CID 53400370 has a molecular weight of 159.28 g/mol, XLogP of 1.66, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 53400370 is sourced from PubChem (CID 53400370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).