CID 134892538

C7H8NOSi — CID 134892538

IUPAC—
SMILESC=CCC(C#N)(C=C)O[Si]
InChIInChI=1S/C7H8NOSi/c1-3-5-7(4-2,6-8)9-10/h3-4H,1-2,5H2
InChIKeyUFBTVWGHPPIKEK-UHFFFAOYSA-N
MW150.23 g/mol
LogP1.11
Rot. Bonds4

About CID 134892538

CID 134892538 (PubChem CID 134892538) has the molecular formula C7H8NOSi and a molecular weight of 150.23 g/mol.

Molecular Properties

Compound NameCID 134892538
PubChem CID134892538
Molecular FormulaC7H8NOSi
Molecular Weight150.23 g/mol
Exact Mass150.04
IUPAC Name—
SMILESC=CCC(C#N)(C=C)O[Si]
InChIInChI=1S/C7H8NOSi/c1-3-5-7(4-2,6-8)9-10/h3-4H,1-2,5H2
InChIKeyUFBTVWGHPPIKEK-UHFFFAOYSA-N
XLogP1.11
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.23
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 134892538?
The IUPAC name of CID 134892538 (CID 134892538) is not available.
What is the SMILES notation for CID 134892538?
The canonical SMILES for CID 134892538 is C=CCC(C#N)(C=C)O[Si].
What is the InChIKey of CID 134892538?
The InChIKey is UFBTVWGHPPIKEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8NOSi/c1-3-5-7(4-2,6-8)9-10/h3-4H,1-2,5H2.
What are the key properties of CID 134892538?
CID 134892538 has a molecular weight of 150.23 g/mol, XLogP of 1.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134892538 is sourced from PubChem (CID 134892538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).