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

C8H17F2NOSi — CID 174136274

IUPAC3-[difluoro(methyl)silyl]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)CC[Si](C)(F)F
InChIInChI=1S/C8H17F2NOSi/c1-4-11(5-2)8(12)6-7-13(3,9)10/h4-7H2,1-3H3
InChIKeyWUDWQKKUEGHQPG-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.26
Rot. Bonds5

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

3-[difluoro(methyl)silyl]-N,N-diethylpropanamide (PubChem CID 174136274) has the molecular formula C8H17F2NOSi and a molecular weight of 209.31 g/mol. Its IUPAC name is 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide.

Molecular Properties

Compound Name3-[difluoro(methyl)silyl]-N,N-diethylpropanamide
PubChem CID174136274
Molecular FormulaC8H17F2NOSi
Molecular Weight209.31 g/mol
Exact Mass209.10
IUPAC Name3-[difluoro(methyl)silyl]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)CC[Si](C)(F)F
InChIInChI=1S/C8H17F2NOSi/c1-4-11(5-2)8(12)6-7-13(3,9)10/h4-7H2,1-3H3
InChIKeyWUDWQKKUEGHQPG-UHFFFAOYSA-N
XLogP2.26
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.26
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-diethylpropanamide?
The IUPAC name of 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide (CID 174136274) is 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide.
What is the SMILES notation for 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide?
The canonical SMILES for 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide is CCN(CC)C(=O)CC[Si](C)(F)F.
What is the InChIKey of 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide?
The InChIKey is WUDWQKKUEGHQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17F2NOSi/c1-4-11(5-2)8(12)6-7-13(3,9)10/h4-7H2,1-3H3.
What are the key properties of 3-[difluoro(methyl)silyl]-N,N-diethylpropanamide?
3-[difluoro(methyl)silyl]-N,N-diethylpropanamide has a molecular weight of 209.31 g/mol, XLogP of 2.26, 5 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-diethylpropanamide is sourced from PubChem (CID 174136274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).