CID 18314663

C9H7OSi — CID 18314663

IUPAC
SMILES[Si]OC1=CCc2ccccc21
InChIInChI=1S/C9H7OSi/c11-10-9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5H2
InChIKeyHQIVGMBSNMZEPD-UHFFFAOYSA-N
MW159.24 g/mol
LogP1.68
Rot. Bonds1

About CID 18314663

CID 18314663 (PubChem CID 18314663) has the molecular formula C9H7OSi and a molecular weight of 159.24 g/mol.

Molecular Properties

Compound NameCID 18314663
PubChem CID18314663
Molecular FormulaC9H7OSi
Molecular Weight159.24 g/mol
Exact Mass159.03
IUPAC Name
SMILES[Si]OC1=CCc2ccccc21
InChIInChI=1S/C9H7OSi/c11-10-9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5H2
InChIKeyHQIVGMBSNMZEPD-UHFFFAOYSA-N
XLogP1.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.24
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 18314663 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 18314663?
The IUPAC name of CID 18314663 (CID 18314663) is not available.
What is the SMILES notation for CID 18314663?
The canonical SMILES for CID 18314663 is [Si]OC1=CCc2ccccc21.
What is the InChIKey of CID 18314663?
The InChIKey is HQIVGMBSNMZEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7OSi/c11-10-9-6-5-7-3-1-2-4-8(7)9/h1-4,6H,5H2.
What are the key properties of CID 18314663?
CID 18314663 has a molecular weight of 159.24 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18314663 is sourced from PubChem (CID 18314663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).