CID 14549696

C5H9Si — CID 14549696

IUPAC—
SMILESC=C(C)CC[Si]
InChIInChI=1S/C5H9Si/c1-5(2)3-4-6/h1,3-4H2,2H3
InChIKeyLRXBUCAJHYNLKB-UHFFFAOYSA-N
MW97.21 g/mol
LogP1.54
Rot. Bonds2

About CID 14549696

CID 14549696 (PubChem CID 14549696) has the molecular formula C5H9Si and a molecular weight of 97.21 g/mol.

Molecular Properties

Compound NameCID 14549696
PubChem CID14549696
Molecular FormulaC5H9Si
Molecular Weight97.21 g/mol
Exact Mass97.05
IUPAC Name—
SMILESC=C(C)CC[Si]
InChIInChI=1S/C5H9Si/c1-5(2)3-4-6/h1,3-4H2,2H3
InChIKeyLRXBUCAJHYNLKB-UHFFFAOYSA-N
XLogP1.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.21
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 14549696 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 14549696?
The IUPAC name of CID 14549696 (CID 14549696) is not available.
What is the SMILES notation for CID 14549696?
The canonical SMILES for CID 14549696 is C=C(C)CC[Si].
What is the InChIKey of CID 14549696?
The InChIKey is LRXBUCAJHYNLKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9Si/c1-5(2)3-4-6/h1,3-4H2,2H3.
What are the key properties of CID 14549696?
CID 14549696 has a molecular weight of 97.21 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 14549696 is sourced from PubChem (CID 14549696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).