3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide

C6H13F2NOSi — CID 174136182

IUPAC3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CC[Si](C)(F)F
InChIInChI=1S/C6H13F2NOSi/c1-9(2)6(10)4-5-11(3,7)8/h4-5H2,1-3H3
InChIKeyFITYUBYPADJEHG-UHFFFAOYSA-N
MW181.26 g/mol
LogP1.48
Rot. Bonds3

About 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide

3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide (PubChem CID 174136182) has the molecular formula C6H13F2NOSi and a molecular weight of 181.26 g/mol. Its IUPAC name is 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide
PubChem CID174136182
Molecular FormulaC6H13F2NOSi
Molecular Weight181.26 g/mol
Exact Mass181.07
IUPAC Name3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CC[Si](C)(F)F
InChIInChI=1S/C6H13F2NOSi/c1-9(2)6(10)4-5-11(3,7)8/h4-5H2,1-3H3
InChIKeyFITYUBYPADJEHG-UHFFFAOYSA-N
XLogP1.48
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide?
The IUPAC name of 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide (CID 174136182) is 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide is CN(C)C(=O)CC[Si](C)(F)F.
What is the InChIKey of 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide?
The InChIKey is FITYUBYPADJEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13F2NOSi/c1-9(2)6(10)4-5-11(3,7)8/h4-5H2,1-3H3.
What are the key properties of 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide?
3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide has a molecular weight of 181.26 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[difluoro(methyl)silyl]-N,N-dimethylpropanamide is sourced from PubChem (CID 174136182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).