CID 88793371

C3H7NOSi — CID 88793371

IUPAC—
SMILESC[Si]C.N=C=O
InChIInChI=1S/C2H6Si.CHNO/c1-3-2;2-1-3/h1-2H3;2H
InChIKeyIZLZFZHFVWEUEA-UHFFFAOYSA-N
MW101.18 g/mol
LogP0.69
Rot. Bonds

About CID 88793371

CID 88793371 (PubChem CID 88793371) has the molecular formula C3H7NOSi and a molecular weight of 101.18 g/mol.

Molecular Properties

Compound NameCID 88793371
PubChem CID88793371
Molecular FormulaC3H7NOSi
Molecular Weight101.18 g/mol
Exact Mass101.03
IUPAC Name—
SMILESC[Si]C.N=C=O
InChIInChI=1S/C2H6Si.CHNO/c1-3-2;2-1-3/h1-2H3;2H
InChIKeyIZLZFZHFVWEUEA-UHFFFAOYSA-N
XLogP0.69
TPSA40.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.18
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isocyanate', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 88793371?
The IUPAC name of CID 88793371 (CID 88793371) is not available.
What is the SMILES notation for CID 88793371?
The canonical SMILES for CID 88793371 is C[Si]C.N=C=O.
What is the InChIKey of CID 88793371?
The InChIKey is IZLZFZHFVWEUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6Si.CHNO/c1-3-2;2-1-3/h1-2H3;2H.
What are the key properties of CID 88793371?
CID 88793371 has a molecular weight of 101.18 g/mol, XLogP of 0.69, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88793371 is sourced from PubChem (CID 88793371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).