(E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine

C15H16F3NSi — CID 58611157

IUPAC(E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine
SMILESC[Si](C)(C)/N=C(\c1ccc2ccccc2c1)C(F)(F)F
InChIInChI=1S/C15H16F3NSi/c1-20(2,3)19-14(15(16,17)18)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3/b19-14+
InChIKeySFZRWWACHCKTJT-XMHGGMMESA-N
MW295.38 g/mol
LogP5.03
Rot. Bonds2

About (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine

(E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine (PubChem CID 58611157) has the molecular formula C15H16F3NSi and a molecular weight of 295.38 g/mol. Its IUPAC name is (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine.

Molecular Properties

Compound Name(E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine
PubChem CID58611157
Molecular FormulaC15H16F3NSi
Molecular Weight295.38 g/mol
Exact Mass295.10
IUPAC Name(E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine
SMILESC[Si](C)(C)/N=C(\c1ccc2ccccc2c1)C(F)(F)F
InChIInChI=1S/C15H16F3NSi/c1-20(2,3)19-14(15(16,17)18)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3/b19-14+
InChIKeySFZRWWACHCKTJT-XMHGGMMESA-N
XLogP5.03
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.38
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine?
The IUPAC name of (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine (CID 58611157) is (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine.
What is the SMILES notation for (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine?
The canonical SMILES for (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine is C[Si](C)(C)/N=C(\c1ccc2ccccc2c1)C(F)(F)F.
What is the InChIKey of (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine?
The InChIKey is SFZRWWACHCKTJT-XMHGGMMESA-N. The full InChI is InChI=1S/C15H16F3NSi/c1-20(2,3)19-14(15(16,17)18)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3/b19-14+.
What are the key properties of (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine?
(E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine has a molecular weight of 295.38 g/mol, XLogP of 5.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,2,2-trifluoro-1-naphthalen-2-yl-N-trimethylsilylethanimine is sourced from PubChem (CID 58611157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).