CID 86021218

C10H21OSi — CID 86021218

IUPAC—
SMILESCC[Si](CC)OC(C)C=C(C)C
InChIInChI=1S/C10H21OSi/c1-6-12(7-2)11-10(5)8-9(3)4/h8,10H,6-7H2,1-5H3
InChIKeyFVCCXRWJYBKBGQ-UHFFFAOYSA-N
MW185.36 g/mol
LogP3.39
Rot. Bonds5

About CID 86021218

CID 86021218 (PubChem CID 86021218) has the molecular formula C10H21OSi and a molecular weight of 185.36 g/mol.

Molecular Properties

Compound NameCID 86021218
PubChem CID86021218
Molecular FormulaC10H21OSi
Molecular Weight185.36 g/mol
Exact Mass185.14
IUPAC Name—
SMILESCC[Si](CC)OC(C)C=C(C)C
InChIInChI=1S/C10H21OSi/c1-6-12(7-2)11-10(5)8-9(3)4/h8,10H,6-7H2,1-5H3
InChIKeyFVCCXRWJYBKBGQ-UHFFFAOYSA-N
XLogP3.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.36
LogP ≤ 53.39
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 86021218 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 86021218?
The IUPAC name of CID 86021218 (CID 86021218) is not available.
What is the SMILES notation for CID 86021218?
The canonical SMILES for CID 86021218 is CC[Si](CC)OC(C)C=C(C)C.
What is the InChIKey of CID 86021218?
The InChIKey is FVCCXRWJYBKBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21OSi/c1-6-12(7-2)11-10(5)8-9(3)4/h8,10H,6-7H2,1-5H3.
What are the key properties of CID 86021218?
CID 86021218 has a molecular weight of 185.36 g/mol, XLogP of 3.39, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 86021218 is sourced from PubChem (CID 86021218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).