CID 154617751

C4H9BrNSi2 — CID 154617751

IUPAC
SMILESCCC(C)N([Si])[Si]Br
InChIInChI=1S/C4H9BrNSi2/c1-3-4(2)6(7)8-5/h4H,3H2,1-2H3
InChIKeyLDJRLCMTDPYOOX-UHFFFAOYSA-N
MW207.20 g/mol
LogP1.10
Rot. Bonds3

About CID 154617751

CID 154617751 (PubChem CID 154617751) has the molecular formula C4H9BrNSi2 and a molecular weight of 207.20 g/mol.

Molecular Properties

Compound NameCID 154617751
PubChem CID154617751
Molecular FormulaC4H9BrNSi2
Molecular Weight207.20 g/mol
Exact Mass205.95
IUPAC Name
SMILESCCC(C)N([Si])[Si]Br
InChIInChI=1S/C4H9BrNSi2/c1-3-4(2)6(7)8-5/h4H,3H2,1-2H3
InChIKeyLDJRLCMTDPYOOX-UHFFFAOYSA-N
XLogP1.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 154617751?
The IUPAC name of CID 154617751 (CID 154617751) is not available.
What is the SMILES notation for CID 154617751?
The canonical SMILES for CID 154617751 is CCC(C)N([Si])[Si]Br.
What is the InChIKey of CID 154617751?
The InChIKey is LDJRLCMTDPYOOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9BrNSi2/c1-3-4(2)6(7)8-5/h4H,3H2,1-2H3.
What are the key properties of CID 154617751?
CID 154617751 has a molecular weight of 207.20 g/mol, XLogP of 1.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154617751 is sourced from PubChem (CID 154617751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).