3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide

C7H14F3NOSi — CID 57209186

IUPAC3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide
SMILESCC(C(N)=O)(C(F)(F)F)[Si](C)(C)C
InChIInChI=1S/C7H14F3NOSi/c1-6(5(11)12,7(8,9)10)13(2,3)4/h1-4H3,(H2,11,12)
InChIKeyLLSNAQSDTYPGBT-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.13
Rot. Bonds2

About 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide

3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide (PubChem CID 57209186) has the molecular formula C7H14F3NOSi and a molecular weight of 213.28 g/mol. Its IUPAC name is 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide.

Molecular Properties

Compound Name3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide
PubChem CID57209186
Molecular FormulaC7H14F3NOSi
Molecular Weight213.28 g/mol
Exact Mass213.08
IUPAC Name3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide
SMILESCC(C(N)=O)(C(F)(F)F)[Si](C)(C)C
InChIInChI=1S/C7H14F3NOSi/c1-6(5(11)12,7(8,9)10)13(2,3)4/h1-4H3,(H2,11,12)
InChIKeyLLSNAQSDTYPGBT-UHFFFAOYSA-N
XLogP2.13
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[tert-Butyl(dimethyl)silyl]-2,2,2-trifluoroacetamide
CID 14325428
Bis-trimethylsilyltrifluoromethylacetamide
CID 21649150
Butyl-dimethylsilyl trifluoroacetamide
CID 56620199
N-methyl-N-t-butyldimethylsilyl trifluoroacetamide
CID 129664734
N-[ethyl(dimethyl)silyl]-2,2,2-trifluoroacetamide
CID 129689313
N-methyl-N-trifluorotrimethylsilyl acetamide
CID 129848424
alpha,alpha-Difluoro-alpha-(tms)-acetamide
CID 139291520
N-methyl-trimethylsilyltrifluormethylacetamide
CID 129776095
2,2,2-trifluoro-N-tributylsilylacetamide
CID 20314537
3,3,3-trifluoro-N-trimethylsilylpropanamide
CID 21411498
2-[Dimethyl(3,3,3-trifluoropropyl)silyl]propanamide
CID 57294112
3,3,3-Trifluoro-2-(trifluoromethyl)-2-trimethylsilylpropanamide
CID 87094722

Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide?
The IUPAC name of 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide (CID 57209186) is 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide.
What is the SMILES notation for 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide?
The canonical SMILES for 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide is CC(C(N)=O)(C(F)(F)F)[Si](C)(C)C.
What is the InChIKey of 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide?
The InChIKey is LLSNAQSDTYPGBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3NOSi/c1-6(5(11)12,7(8,9)10)13(2,3)4/h1-4H3,(H2,11,12).
What are the key properties of 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide?
3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide has a molecular weight of 213.28 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-2-methyl-2-trimethylsilylpropanamide is sourced from PubChem (CID 57209186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).