CID 173308465

C17H17Si — CID 173308465

IUPAC
SMILESC[Si](C)c1ccccc1C1C=Cc2ccccc21
InChIInChI=1S/C17H17Si/c1-18(2)17-10-6-5-9-16(17)15-12-11-13-7-3-4-8-14(13)15/h3-12,15H,1-2H3
InChIKeyJLTIYTAPPLCUCB-UHFFFAOYSA-N
MW249.41 g/mol
LogP3.81
Rot. Bonds2

About CID 173308465

CID 173308465 (PubChem CID 173308465) has the molecular formula C17H17Si and a molecular weight of 249.41 g/mol.

Molecular Properties

Compound NameCID 173308465
PubChem CID173308465
Molecular FormulaC17H17Si
Molecular Weight249.41 g/mol
Exact Mass249.11
IUPAC Name
SMILESC[Si](C)c1ccccc1C1C=Cc2ccccc21
InChIInChI=1S/C17H17Si/c1-18(2)17-10-6-5-9-16(17)15-12-11-13-7-3-4-8-14(13)15/h3-12,15H,1-2H3
InChIKeyJLTIYTAPPLCUCB-UHFFFAOYSA-N
XLogP3.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.41
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 173308465?
The IUPAC name of CID 173308465 (CID 173308465) is not available.
What is the SMILES notation for CID 173308465?
The canonical SMILES for CID 173308465 is C[Si](C)c1ccccc1C1C=Cc2ccccc21.
What is the InChIKey of CID 173308465?
The InChIKey is JLTIYTAPPLCUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Si/c1-18(2)17-10-6-5-9-16(17)15-12-11-13-7-3-4-8-14(13)15/h3-12,15H,1-2H3.
What are the key properties of CID 173308465?
CID 173308465 has a molecular weight of 249.41 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173308465 is sourced from PubChem (CID 173308465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).