CID 68817184

C12H23OSi — CID 68817184

IUPAC—
SMILESC[Si](C)OC1=CC(C(C)(C)C)CCC1
InChIInChI=1S/C12H23OSi/c1-12(2,3)10-7-6-8-11(9-10)13-14(4)5/h9-10H,6-8H2,1-5H3
InChIKeyZBZXMQKKOLBGNA-UHFFFAOYSA-N
MW211.40 g/mol
LogP3.98
Rot. Bonds2

About CID 68817184

CID 68817184 (PubChem CID 68817184) has the molecular formula C12H23OSi and a molecular weight of 211.40 g/mol.

Molecular Properties

Compound NameCID 68817184
PubChem CID68817184
Molecular FormulaC12H23OSi
Molecular Weight211.40 g/mol
Exact Mass211.15
IUPAC Name—
SMILESC[Si](C)OC1=CC(C(C)(C)C)CCC1
InChIInChI=1S/C12H23OSi/c1-12(2,3)10-7-6-8-11(9-10)13-14(4)5/h9-10H,6-8H2,1-5H3
InChIKeyZBZXMQKKOLBGNA-UHFFFAOYSA-N
XLogP3.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.40
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 68817184 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 68817184?
The IUPAC name of CID 68817184 (CID 68817184) is not available.
What is the SMILES notation for CID 68817184?
The canonical SMILES for CID 68817184 is C[Si](C)OC1=CC(C(C)(C)C)CCC1.
What is the InChIKey of CID 68817184?
The InChIKey is ZBZXMQKKOLBGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23OSi/c1-12(2,3)10-7-6-8-11(9-10)13-14(4)5/h9-10H,6-8H2,1-5H3.
What are the key properties of CID 68817184?
CID 68817184 has a molecular weight of 211.40 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68817184 is sourced from PubChem (CID 68817184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).