CID 58003876

C11H23NO2Si- — CID 58003876

IUPAC—
SMILESC[Si](C)OC1CC(C)(C)N([O-])C(C)(C)C1
InChIInChI=1S/C11H23NO2Si/c1-10(2)7-9(14-15(5)6)8-11(3,4)12(10)13/h9H,7-8H2,1-6H3/q-1
InChIKeyRYLALNJVNRMYEQ-UHFFFAOYSA-N
MW229.40 g/mol
LogP2.77
Rot. Bonds2

About CID 58003876

CID 58003876 (PubChem CID 58003876) has the molecular formula C11H23NO2Si- and a molecular weight of 229.40 g/mol.

Molecular Properties

Compound NameCID 58003876
PubChem CID58003876
Molecular FormulaC11H23NO2Si-
Molecular Weight229.40 g/mol
Exact Mass229.15
IUPAC Name—
SMILESC[Si](C)OC1CC(C)(C)N([O-])C(C)(C)C1
InChIInChI=1S/C11H23NO2Si/c1-10(2)7-9(14-15(5)6)8-11(3,4)12(10)13/h9H,7-8H2,1-6H3/q-1
InChIKeyRYLALNJVNRMYEQ-UHFFFAOYSA-N
XLogP2.77
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.40
LogP ≤ 52.77
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 58003876?
The IUPAC name of CID 58003876 (CID 58003876) is not available.
What is the SMILES notation for CID 58003876?
The canonical SMILES for CID 58003876 is C[Si](C)OC1CC(C)(C)N([O-])C(C)(C)C1.
What is the InChIKey of CID 58003876?
The InChIKey is RYLALNJVNRMYEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2Si/c1-10(2)7-9(14-15(5)6)8-11(3,4)12(10)13/h9H,7-8H2,1-6H3/q-1.
What are the key properties of CID 58003876?
CID 58003876 has a molecular weight of 229.40 g/mol, XLogP of 2.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58003876 is sourced from PubChem (CID 58003876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).