N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide

C11H15F2NOSi — CID 101479656

IUPACN-(3,4-difluoro-2-trimethylsilylphenyl)acetamide
SMILESCC(=O)Nc1ccc(F)c(F)c1[Si](C)(C)C
InChIInChI=1S/C11H15F2NOSi/c1-7(15)14-9-6-5-8(12)10(13)11(9)16(2,3)4/h5-6H,1-4H3,(H,14,15)
InChIKeyBXXBHENSPWQHHA-UHFFFAOYSA-N
MW243.33 g/mol
LogP2.47
Rot. Bonds2

About N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide

N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide (PubChem CID 101479656) has the molecular formula C11H15F2NOSi and a molecular weight of 243.33 g/mol. Its IUPAC name is N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide.

Molecular Properties

Compound NameN-(3,4-difluoro-2-trimethylsilylphenyl)acetamide
PubChem CID101479656
Molecular FormulaC11H15F2NOSi
Molecular Weight243.33 g/mol
Exact Mass243.09
IUPAC NameN-(3,4-difluoro-2-trimethylsilylphenyl)acetamide
SMILESCC(=O)Nc1ccc(F)c(F)c1[Si](C)(C)C
InChIInChI=1S/C11H15F2NOSi/c1-7(15)14-9-6-5-8(12)10(13)11(9)16(2,3)4/h5-6H,1-4H3,(H,14,15)
InChIKeyBXXBHENSPWQHHA-UHFFFAOYSA-N
XLogP2.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 52.47
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-(3,4-difluoro-2-methylphenyl)acetamide
CID 15692403
N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide
CID 67281170
N-(4-chloro-2-fluorophenyl)acetamide;hydrochloride
CID 142696618
N-(4-acetamido-2,5-difluorophenyl)acetamide
CID 176892585
(2,3-difluoro-6-methylsulfanylphenyl)-trimethylsilane
CID 171366311
1-propan-2-yl-3-(2,3,4-trifluorophenyl)urea
CID 47173418
N-(4-acetamido-2,1,3-benzoxadiazol-7-yl)acetamide
CID 135276709
2,4-difluoro-3-trimethylsilylbenzoic acid
CID 11579522
methyl 2-[(6-acetamido-2,3-difluorophenyl)methyl]-3-oxobutanoate
CID 139639954
2-methoxy-N-(2,3,4-trifluorophenyl)propanamide
CID 112685527
N-(2,6-difluoro-3-formamidophenyl)acetamide
CID 168651959
N-(2-fluoro-4-iodo-3-methylphenyl)acetamide
CID 166153622

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide?
The IUPAC name of N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide (CID 101479656) is N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide.
What is the SMILES notation for N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide?
The canonical SMILES for N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide is CC(=O)Nc1ccc(F)c(F)c1[Si](C)(C)C.
What is the InChIKey of N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide?
The InChIKey is BXXBHENSPWQHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NOSi/c1-7(15)14-9-6-5-8(12)10(13)11(9)16(2,3)4/h5-6H,1-4H3,(H,14,15).
What are the key properties of N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide?
N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide has a molecular weight of 243.33 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide is sourced from PubChem (CID 101479656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).