carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc

C9H19F3N3O4SiZn-3 — CID 22385994

IUPACcarbonofluoridoylazanide;triethyl(hydroxy)silane;zinc
SMILESCC[Si](O)(CC)CC.[NH-]C(=O)F.[NH-]C(=O)F.[NH-]C(=O)F.[Zn]
InChIInChI=1S/C6H16OSi.3CH2FNO.Zn/c1-4-8(7,5-2)6-3;3*2-1(3)4;/h7H,4-6H2,1-3H3;3*(H2,3,4);/p-3
InChIKeyDIRBKVPJLPGXEL-UHFFFAOYSA-K
MW383.74 g/mol
LogP5.37
Rot. Bonds3

About carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc

carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc (PubChem CID 22385994) has the molecular formula C9H19F3N3O4SiZn-3 and a molecular weight of 383.74 g/mol. Its IUPAC name is carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc.

Molecular Properties

Compound Namecarbonofluoridoylazanide;triethyl(hydroxy)silane;zinc
PubChem CID22385994
Molecular FormulaC9H19F3N3O4SiZn-3
Molecular Weight383.74 g/mol
Exact Mass382.04
IUPAC Namecarbonofluoridoylazanide;triethyl(hydroxy)silane;zinc
SMILESCC[Si](O)(CC)CC.[NH-]C(=O)F.[NH-]C(=O)F.[NH-]C(=O)F.[Zn]
InChIInChI=1S/C6H16OSi.3CH2FNO.Zn/c1-4-8(7,5-2)6-3;3*2-1(3)4;/h7H,4-6H2,1-3H3;3*(H2,3,4);/p-3
InChIKeyDIRBKVPJLPGXEL-UHFFFAOYSA-K
XLogP5.37
TPSA142.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.74
LogP ≤ 55.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc?
The IUPAC name of carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc (CID 22385994) is carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc.
What is the SMILES notation for carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc?
The canonical SMILES for carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc is CC[Si](O)(CC)CC.[NH-]C(=O)F.[NH-]C(=O)F.[NH-]C(=O)F.[Zn].
What is the InChIKey of carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc?
The InChIKey is DIRBKVPJLPGXEL-UHFFFAOYSA-K. The full InChI is InChI=1S/C6H16OSi.3CH2FNO.Zn/c1-4-8(7,5-2)6-3;3*2-1(3)4;/h7H,4-6H2,1-3H3;3*(H2,3,4);/p-3.
What are the key properties of carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc?
carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc has a molecular weight of 383.74 g/mol, XLogP of 5.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbonofluoridoylazanide;triethyl(hydroxy)silane;zinc is sourced from PubChem (CID 22385994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).