CID 175168561

C16H10N2O5Si2 — CID 175168561

IUPAC—
SMILESO=C1NC(=O)c2ccccc21.O=C1NC(=O)c2ccccc21.[Si]O[Si]
InChIInChI=1S/2C8H5NO2.OSi2/c2*10-7-5-3-1-2-4-6(5)8(11)9-7;2-1-3/h2*1-4H,(H,9,10,11);
InChIKeyYXTMJBHUNGJXMB-UHFFFAOYSA-N
MW366.44 g/mol
LogP0.31
Rot. Bonds

About CID 175168561

CID 175168561 (PubChem CID 175168561) has the molecular formula C16H10N2O5Si2 and a molecular weight of 366.44 g/mol.

Molecular Properties

Compound NameCID 175168561
PubChem CID175168561
Molecular FormulaC16H10N2O5Si2
Molecular Weight366.44 g/mol
Exact Mass366.01
IUPAC Name—
SMILESO=C1NC(=O)c2ccccc21.O=C1NC(=O)c2ccccc21.[Si]O[Si]
InChIInChI=1S/2C8H5NO2.OSi2/c2*10-7-5-3-1-2-4-6(5)8(11)9-7;2-1-3/h2*1-4H,(H,9,10,11);
InChIKeyYXTMJBHUNGJXMB-UHFFFAOYSA-N
XLogP0.31
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 175168561?
The IUPAC name of CID 175168561 (CID 175168561) is not available.
What is the SMILES notation for CID 175168561?
The canonical SMILES for CID 175168561 is O=C1NC(=O)c2ccccc21.O=C1NC(=O)c2ccccc21.[Si]O[Si].
What is the InChIKey of CID 175168561?
The InChIKey is YXTMJBHUNGJXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H5NO2.OSi2/c2*10-7-5-3-1-2-4-6(5)8(11)9-7;2-1-3/h2*1-4H,(H,9,10,11);.
What are the key properties of CID 175168561?
CID 175168561 has a molecular weight of 366.44 g/mol, XLogP of 0.31, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175168561 is sourced from PubChem (CID 175168561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).