CID 67811574

C7H5FN2Si — CID 67811574

IUPAC
SMILESF[Si]c1nc2ccccc2[nH]1
InChIInChI=1S/C7H5FN2Si/c8-11-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10)
InChIKeyLUDSXHLLNFAWTL-UHFFFAOYSA-N
MW164.22 g/mol
LogP0.78
Rot. Bonds1

About CID 67811574

CID 67811574 (PubChem CID 67811574) has the molecular formula C7H5FN2Si and a molecular weight of 164.22 g/mol.

Molecular Properties

Compound NameCID 67811574
PubChem CID67811574
Molecular FormulaC7H5FN2Si
Molecular Weight164.22 g/mol
Exact Mass164.02
IUPAC Name
SMILESF[Si]c1nc2ccccc2[nH]1
InChIInChI=1S/C7H5FN2Si/c8-11-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10)
InChIKeyLUDSXHLLNFAWTL-UHFFFAOYSA-N
XLogP0.78
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.22
LogP ≤ 50.78
H-Bond Donors ≤ 51
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 67811574?
The IUPAC name of CID 67811574 (CID 67811574) is not available.
What is the SMILES notation for CID 67811574?
The canonical SMILES for CID 67811574 is F[Si]c1nc2ccccc2[nH]1.
What is the InChIKey of CID 67811574?
The InChIKey is LUDSXHLLNFAWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN2Si/c8-11-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10).
What are the key properties of CID 67811574?
CID 67811574 has a molecular weight of 164.22 g/mol, XLogP of 0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67811574 is sourced from PubChem (CID 67811574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).