CID 22559359

C11H21OSi — CID 22559359

IUPAC—
SMILESCC(C)[Si](C1=CCCCO1)C(C)C
InChIInChI=1S/C11H21OSi/c1-9(2)13(10(3)4)11-7-5-6-8-12-11/h7,9-10H,5-6,8H2,1-4H3
InChIKeyZAYZLFGTLDQJGX-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.53
Rot. Bonds3

About CID 22559359

CID 22559359 (PubChem CID 22559359) has the molecular formula C11H21OSi and a molecular weight of 197.37 g/mol.

Molecular Properties

Compound NameCID 22559359
PubChem CID22559359
Molecular FormulaC11H21OSi
Molecular Weight197.37 g/mol
Exact Mass197.14
IUPAC Name—
SMILESCC(C)[Si](C1=CCCCO1)C(C)C
InChIInChI=1S/C11H21OSi/c1-9(2)13(10(3)4)11-7-5-6-8-12-11/h7,9-10H,5-6,8H2,1-4H3
InChIKeyZAYZLFGTLDQJGX-UHFFFAOYSA-N
XLogP3.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 22559359 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 22559359?
The IUPAC name of CID 22559359 (CID 22559359) is not available.
What is the SMILES notation for CID 22559359?
The canonical SMILES for CID 22559359 is CC(C)[Si](C1=CCCCO1)C(C)C.
What is the InChIKey of CID 22559359?
The InChIKey is ZAYZLFGTLDQJGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21OSi/c1-9(2)13(10(3)4)11-7-5-6-8-12-11/h7,9-10H,5-6,8H2,1-4H3.
What are the key properties of CID 22559359?
CID 22559359 has a molecular weight of 197.37 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22559359 is sourced from PubChem (CID 22559359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).