N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide

C20H40F3NOSi — CID 175690586

IUPACN-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide
SMILESCCCCCCCCCCCCCCC[Si](C)(C)N(C)C(=O)C(F)(F)F
InChIInChI=1S/C20H40F3NOSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(3,4)24(2)19(25)20(21,22)23/h5-18H2,1-4H3
InChIKeyJUFLWJBYWCJHOT-UHFFFAOYSA-N
MW395.63 g/mol
LogP7.30
Rot. Bonds15

About N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide

N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide (PubChem CID 175690586) has the molecular formula C20H40F3NOSi and a molecular weight of 395.63 g/mol. Its IUPAC name is N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide.

Molecular Properties

Compound NameN-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide
PubChem CID175690586
Molecular FormulaC20H40F3NOSi
Molecular Weight395.63 g/mol
Exact Mass395.28
IUPAC NameN-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide
SMILESCCCCCCCCCCCCCCC[Si](C)(C)N(C)C(=O)C(F)(F)F
InChIInChI=1S/C20H40F3NOSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(3,4)24(2)19(25)20(21,22)23/h5-18H2,1-4H3
InChIKeyJUFLWJBYWCJHOT-UHFFFAOYSA-N
XLogP7.30
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.63
LogP ≤ 57.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,2,2-trifluoro-N-[heptyl(dimethyl)silyl]-N-methylacetamide
CID 175690640
N-[dimethyl(pentyl)silyl]-N-methylmethanamine
CID 175854562
[decyl-bis[(2,2,2-trifluoroacetyl)oxy]silyl] 2,2,2-trifluoroacetate
CID 175690446
N-butyl-2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
CID 87858972
2,2,2-trifluoro-N-(1-pentadecoxypropyl)-N-propylacetamide
CID 173325025
2,2,2-trifluoro-N-icosylacetamide
CID 91692791
N-dodecyl-2-(18F)fluoro-2,2-difluoroacetamide
CID 177484696
2,2-difluoro-N-methoxy-N-methyltetradecanamide
CID 89479266
N-ethyl-2,2,2-trifluoro-N-methylacetamide
CID 57170952
octan-1-ol;2,2,2-trifluoroacetic acid
CID 87098576
hydroxy-dimethyl-octadecylsilane
CID 11198256
[methyl-(2,2,2-trifluoroacetyl)amino]azanide
CID 163589584

Frequently Asked Questions

What is the IUPAC name of N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide?
The IUPAC name of N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide (CID 175690586) is N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide.
What is the SMILES notation for N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide?
The canonical SMILES for N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide is CCCCCCCCCCCCCCC[Si](C)(C)N(C)C(=O)C(F)(F)F.
What is the InChIKey of N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide?
The InChIKey is JUFLWJBYWCJHOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40F3NOSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(3,4)24(2)19(25)20(21,22)23/h5-18H2,1-4H3.
What are the key properties of N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide?
N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide has a molecular weight of 395.63 g/mol, XLogP of 7.30, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethyl(pentadecyl)silyl]-2,2,2-trifluoro-N-methylacetamide is sourced from PubChem (CID 175690586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).