CID 100919819

C17H39OSi4 — CID 100919819

IUPAC—
SMILESCC1(C)CCC([O])=CC1[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H39OSi4/c1-17(2)13-12-15(18)14-16(17)22(19(3,4)5,20(6,7)8)21(9,10)11/h14,16H,12-13H2,1-11H3
InChIKeyCKWIQJJHOORGPG-UHFFFAOYSA-N
MW371.84 g/mol
LogP6.19
Rot. Bonds4

About CID 100919819

CID 100919819 (PubChem CID 100919819) has the molecular formula C17H39OSi4 and a molecular weight of 371.84 g/mol.

Molecular Properties

Compound NameCID 100919819
PubChem CID100919819
Molecular FormulaC17H39OSi4
Molecular Weight371.84 g/mol
Exact Mass371.21
IUPAC Name—
SMILESCC1(C)CCC([O])=CC1[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H39OSi4/c1-17(2)13-12-15(18)14-16(17)22(19(3,4)5,20(6,7)8)21(9,10)11/h14,16H,12-13H2,1-11H3
InChIKeyCKWIQJJHOORGPG-UHFFFAOYSA-N
XLogP6.19
TPSA19.90 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.84
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 100919819 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 100919819?
The IUPAC name of CID 100919819 (CID 100919819) is not available.
What is the SMILES notation for CID 100919819?
The canonical SMILES for CID 100919819 is CC1(C)CCC([O])=CC1[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of CID 100919819?
The InChIKey is CKWIQJJHOORGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H39OSi4/c1-17(2)13-12-15(18)14-16(17)22(19(3,4)5,20(6,7)8)21(9,10)11/h14,16H,12-13H2,1-11H3.
What are the key properties of CID 100919819?
CID 100919819 has a molecular weight of 371.84 g/mol, XLogP of 6.19, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 100919819 is sourced from PubChem (CID 100919819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).