CID 161100319

ClN2OSi — CID 161100319

IUPAC—
SMILES[N-]=[N+]=O.[Si]Cl
InChIInChI=1S/ClSi.N2O/c1-2;1-2-3
InChIKeyAFOGIPGSTUWTLD-UHFFFAOYSA-N
MW107.55 g/mol
LogP0.15
Rot. Bonds

About CID 161100319

CID 161100319 (PubChem CID 161100319) has the molecular formula ClN2OSi and a molecular weight of 107.55 g/mol.

Molecular Properties

Compound NameCID 161100319
PubChem CID161100319
Molecular FormulaClN2OSi
Molecular Weight107.55 g/mol
Exact Mass106.95
IUPAC Name—
SMILES[N-]=[N+]=O.[Si]Cl
InChIInChI=1S/ClSi.N2O/c1-2;1-2-3
InChIKeyAFOGIPGSTUWTLD-UHFFFAOYSA-N
XLogP0.15
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.55
LogP ≤ 50.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 161100319?
The IUPAC name of CID 161100319 (CID 161100319) is not available.
What is the SMILES notation for CID 161100319?
The canonical SMILES for CID 161100319 is [N-]=[N+]=O.[Si]Cl.
What is the InChIKey of CID 161100319?
The InChIKey is AFOGIPGSTUWTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/ClSi.N2O/c1-2;1-2-3.
What are the key properties of CID 161100319?
CID 161100319 has a molecular weight of 107.55 g/mol, XLogP of 0.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 161100319 is sourced from PubChem (CID 161100319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).