CID 142750810

C18H21Si — CID 142750810

IUPAC
SMILESCC[Si](CC)C1C(C)=Cc2c1ccc1ccccc21
InChIInChI=1S/C18H21Si/c1-4-19(5-2)18-13(3)12-17-15-9-7-6-8-14(15)10-11-16(17)18/h6-12,18H,4-5H2,1-3H3
InChIKeyVTLWBXYUKKBBMJ-UHFFFAOYSA-N
MW265.45 g/mol
LogP5.41
Rot. Bonds3

About CID 142750810

CID 142750810 (PubChem CID 142750810) has the molecular formula C18H21Si and a molecular weight of 265.45 g/mol.

Molecular Properties

Compound NameCID 142750810
PubChem CID142750810
Molecular FormulaC18H21Si
Molecular Weight265.45 g/mol
Exact Mass265.14
IUPAC Name
SMILESCC[Si](CC)C1C(C)=Cc2c1ccc1ccccc21
InChIInChI=1S/C18H21Si/c1-4-19(5-2)18-13(3)12-17-15-9-7-6-8-14(15)10-11-16(17)18/h6-12,18H,4-5H2,1-3H3
InChIKeyVTLWBXYUKKBBMJ-UHFFFAOYSA-N
XLogP5.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.45
LogP ≤ 55.41
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 142750810?
The IUPAC name of CID 142750810 (CID 142750810) is not available.
What is the SMILES notation for CID 142750810?
The canonical SMILES for CID 142750810 is CC[Si](CC)C1C(C)=Cc2c1ccc1ccccc21.
What is the InChIKey of CID 142750810?
The InChIKey is VTLWBXYUKKBBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21Si/c1-4-19(5-2)18-13(3)12-17-15-9-7-6-8-14(15)10-11-16(17)18/h6-12,18H,4-5H2,1-3H3.
What are the key properties of CID 142750810?
CID 142750810 has a molecular weight of 265.45 g/mol, XLogP of 5.41, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 142750810 is sourced from PubChem (CID 142750810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).