CID 69448658

C20H29Si — CID 69448658

IUPAC—
SMILESC=Cc1ccc(C23CC(CCC2C)C3(C)C)cc1[Si](C)C
InChIInChI=1S/C20H29Si/c1-7-15-9-11-16(12-18(15)21(5)6)20-13-17(19(20,3)4)10-8-14(20)2/h7,9,11-12,14,17H,1,8,10,13H2,2-6H3
InChIKeyXZTJSFWANGGDFK-UHFFFAOYSA-N
MW297.54 g/mol
LogP5.00
Rot. Bonds3

About CID 69448658

CID 69448658 (PubChem CID 69448658) has the molecular formula C20H29Si and a molecular weight of 297.54 g/mol.

Molecular Properties

Compound NameCID 69448658
PubChem CID69448658
Molecular FormulaC20H29Si
Molecular Weight297.54 g/mol
Exact Mass297.20
IUPAC Name—
SMILESC=Cc1ccc(C23CC(CCC2C)C3(C)C)cc1[Si](C)C
InChIInChI=1S/C20H29Si/c1-7-15-9-11-16(12-18(15)21(5)6)20-13-17(19(20,3)4)10-8-14(20)2/h7,9,11-12,14,17H,1,8,10,13H2,2-6H3
InChIKeyXZTJSFWANGGDFK-UHFFFAOYSA-N
XLogP5.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.54
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 69448658 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 69448658?
The IUPAC name of CID 69448658 (CID 69448658) is not available.
What is the SMILES notation for CID 69448658?
The canonical SMILES for CID 69448658 is C=Cc1ccc(C23CC(CCC2C)C3(C)C)cc1[Si](C)C.
What is the InChIKey of CID 69448658?
The InChIKey is XZTJSFWANGGDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29Si/c1-7-15-9-11-16(12-18(15)21(5)6)20-13-17(19(20,3)4)10-8-14(20)2/h7,9,11-12,14,17H,1,8,10,13H2,2-6H3.
What are the key properties of CID 69448658?
CID 69448658 has a molecular weight of 297.54 g/mol, XLogP of 5.00, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 69448658 is sourced from PubChem (CID 69448658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).