2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline

C15H24F3NSi — CID 141042498

IUPAC2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline
SMILESCC(C)[Si](Nc1cc(F)cc(F)c1F)(C(C)C)C(C)C
InChIInChI=1S/C15H24F3NSi/c1-9(2)20(10(3)4,11(5)6)19-14-8-12(16)7-13(17)15(14)18/h7-11,19H,1-6H3
InChIKeySGALGNGHLFAPNQ-UHFFFAOYSA-N
MW303.44 g/mol
LogP5.69
Rot. Bonds5

About 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline

2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline (PubChem CID 141042498) has the molecular formula C15H24F3NSi and a molecular weight of 303.44 g/mol. Its IUPAC name is 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline.

Molecular Properties

Compound Name2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline
PubChem CID141042498
Molecular FormulaC15H24F3NSi
Molecular Weight303.44 g/mol
Exact Mass303.16
IUPAC Name2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline
SMILESCC(C)[Si](Nc1cc(F)cc(F)c1F)(C(C)C)C(C)C
InChIInChI=1S/C15H24F3NSi/c1-9(2)20(10(3)4,11(5)6)19-14-8-12(16)7-13(17)15(14)18/h7-11,19H,1-6H3
InChIKeySGALGNGHLFAPNQ-UHFFFAOYSA-N
XLogP5.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.44
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2,3,5-trifluoro-N-(2-methylpropyl)aniline
CID 62811497
N-[1-(2,4-difluorophenyl)ethyl]-2,3,5-trifluoroaniline
CID 62810510
2-(2-methylpropyl)-1-(2,3,5-trifluorophenyl)guanidine
CID 62812620
N-(1-cyclohexylethyl)-2,3,5-trifluoroaniline
CID 55193341
3-(2,3,5-trifluoroanilino)butanenitrile
CID 62811152
2-methyl-3-(2,3,5-trifluoroanilino)propanoic acid
CID 62810259
2,3,4,5-tetrafluoro-N-(2,3,5-trifluorophenyl)aniline
CID 22348698
3-(2,3,5-trifluoroanilino)butanoic acid
CID 62810258
2-(2,3,5-trifluoroanilino)acetonitrile
CID 62810613
2,3,5-trifluoro-N-(4-methoxy-4-methylpentan-2-yl)aniline
CID 62811459
2,3,5-trifluoro-N-[(1-propan-2-ylpyrazol-3-yl)methyl]aniline
CID 64772172
2,3,5-trifluoro-N-[1-(5-methylthiophen-2-yl)ethyl]aniline
CID 55119065

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline?
The IUPAC name of 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline (CID 141042498) is 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline.
What is the SMILES notation for 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline?
The canonical SMILES for 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline is CC(C)[Si](Nc1cc(F)cc(F)c1F)(C(C)C)C(C)C.
What is the InChIKey of 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline?
The InChIKey is SGALGNGHLFAPNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24F3NSi/c1-9(2)20(10(3)4,11(5)6)19-14-8-12(16)7-13(17)15(14)18/h7-11,19H,1-6H3.
What are the key properties of 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline?
2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline has a molecular weight of 303.44 g/mol, XLogP of 5.69, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trifluoro-N-tri(propan-2-yl)silylaniline is sourced from PubChem (CID 141042498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).