CID 175407566

C7H8NSi — CID 175407566

IUPAC—
SMILESCc1ccnc([Si])c1C
InChIInChI=1S/C7H8NSi/c1-5-3-4-8-7(9)6(5)2/h3-4H,1-2H3
InChIKeyWLZHUIIHHCTODN-UHFFFAOYSA-N
MW134.23 g/mol
LogP0.49
Rot. Bonds

About CID 175407566

CID 175407566 (PubChem CID 175407566) has the molecular formula C7H8NSi and a molecular weight of 134.23 g/mol.

Molecular Properties

Compound NameCID 175407566
PubChem CID175407566
Molecular FormulaC7H8NSi
Molecular Weight134.23 g/mol
Exact Mass134.04
IUPAC Name—
SMILESCc1ccnc([Si])c1C
InChIInChI=1S/C7H8NSi/c1-5-3-4-8-7(9)6(5)2/h3-4H,1-2H3
InChIKeyWLZHUIIHHCTODN-UHFFFAOYSA-N
XLogP0.49
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.23
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 175407566?
The IUPAC name of CID 175407566 (CID 175407566) is not available.
What is the SMILES notation for CID 175407566?
The canonical SMILES for CID 175407566 is Cc1ccnc([Si])c1C.
What is the InChIKey of CID 175407566?
The InChIKey is WLZHUIIHHCTODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8NSi/c1-5-3-4-8-7(9)6(5)2/h3-4H,1-2H3.
What are the key properties of CID 175407566?
CID 175407566 has a molecular weight of 134.23 g/mol, XLogP of 0.49, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175407566 is sourced from PubChem (CID 175407566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).