CID 10891261

C18H19OSi — CID 10891261

IUPAC—
SMILESC1=CC(O[Si](c2ccccc2)c2ccccc2)CCC1
InChIInChI=1S/C18H19OSi/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h2-4,6-10,12-16H,1,5,11H2
InChIKeyWETMVONSNGHXJY-UHFFFAOYSA-N
MW279.44 g/mol
LogP2.92
Rot. Bonds4

About CID 10891261

CID 10891261 (PubChem CID 10891261) has the molecular formula C18H19OSi and a molecular weight of 279.44 g/mol.

Molecular Properties

Compound NameCID 10891261
PubChem CID10891261
Molecular FormulaC18H19OSi
Molecular Weight279.44 g/mol
Exact Mass279.12
IUPAC Name—
SMILESC1=CC(O[Si](c2ccccc2)c2ccccc2)CCC1
InChIInChI=1S/C18H19OSi/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h2-4,6-10,12-16H,1,5,11H2
InChIKeyWETMVONSNGHXJY-UHFFFAOYSA-N
XLogP2.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.44
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 10891261 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 10891261?
The IUPAC name of CID 10891261 (CID 10891261) is not available.
What is the SMILES notation for CID 10891261?
The canonical SMILES for CID 10891261 is C1=CC(O[Si](c2ccccc2)c2ccccc2)CCC1.
What is the InChIKey of CID 10891261?
The InChIKey is WETMVONSNGHXJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19OSi/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h2-4,6-10,12-16H,1,5,11H2.
What are the key properties of CID 10891261?
CID 10891261 has a molecular weight of 279.44 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10891261 is sourced from PubChem (CID 10891261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).