CID 66769294

C3H3N3Si — CID 66769294

IUPAC—
SMILES[Si].c1cnnnc1
InChIInChI=1S/C3H3N3.Si/c1-2-4-6-5-3-1;/h1-3H;
InChIKeyKWAYGHBLGWNQBS-UHFFFAOYSA-N
MW109.16 g/mol
LogP-0.51
Rot. Bonds

About CID 66769294

CID 66769294 (PubChem CID 66769294) has the molecular formula C3H3N3Si and a molecular weight of 109.16 g/mol.

Molecular Properties

Compound NameCID 66769294
PubChem CID66769294
Molecular FormulaC3H3N3Si
Molecular Weight109.16 g/mol
Exact Mass109.01
IUPAC Name—
SMILES[Si].c1cnnnc1
InChIInChI=1S/C3H3N3.Si/c1-2-4-6-5-3-1;/h1-3H;
InChIKeyKWAYGHBLGWNQBS-UHFFFAOYSA-N
XLogP-0.51
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.16
LogP ≤ 5-0.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 66769294?
The IUPAC name of CID 66769294 (CID 66769294) is not available.
What is the SMILES notation for CID 66769294?
The canonical SMILES for CID 66769294 is [Si].c1cnnnc1.
What is the InChIKey of CID 66769294?
The InChIKey is KWAYGHBLGWNQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.Si/c1-2-4-6-5-3-1;/h1-3H;.
What are the key properties of CID 66769294?
CID 66769294 has a molecular weight of 109.16 g/mol, XLogP of -0.51, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66769294 is sourced from PubChem (CID 66769294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).