N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide

C16H29NO3Si2 — CID 91739849

IUPACN-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide
SMILESCC(=O)NCC(O[Si](C)(C)C)c1ccc(O[Si](C)(C)C)cc1
InChIInChI=1S/C16H29NO3Si2/c1-13(18)17-12-16(20-22(5,6)7)14-8-10-15(11-9-14)19-21(2,3)4/h8-11,16H,12H2,1-7H3,(H,17,18)
InChIKeyNJJCPMJXPFMVDB-UHFFFAOYSA-N
MW339.58 g/mol
LogP3.93
Rot. Bonds7

About N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide

N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide (PubChem CID 91739849) has the molecular formula C16H29NO3Si2 and a molecular weight of 339.58 g/mol. Its IUPAC name is N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide
PubChem CID91739849
Molecular FormulaC16H29NO3Si2
Molecular Weight339.58 g/mol
Exact Mass339.17
IUPAC NameN-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide
SMILESCC(=O)NCC(O[Si](C)(C)C)c1ccc(O[Si](C)(C)C)cc1
InChIInChI=1S/C16H29NO3Si2/c1-13(18)17-12-16(20-22(5,6)7)14-8-10-15(11-9-14)19-21(2,3)4/h8-11,16H,12H2,1-7H3,(H,17,18)
InChIKeyNJJCPMJXPFMVDB-UHFFFAOYSA-N
XLogP3.93
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.58
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 193691
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Vitroprocine D
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Vitroprocine E
CID 156581196
Vitroprocine F
CID 156581197
Vitroprocine G
CID 156581198
N-(Trifluoroacetyl)-O,O',O''-tris(trimethylsilyl)norepinephrine
CID 553889
Noradrenaline, N-HFB-O-TMS
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CID 6428499
Bamethane, N-TFA-O-TMS
CID 6428500
Corbasil, N-TFA-O-TMS
CID 6428501
Hydroxyamphetamine, N-TFA-O-TMS
CID 6428504

Frequently Asked Questions

What is the IUPAC name of N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide?
The IUPAC name of N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide (CID 91739849) is N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide?
The canonical SMILES for N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide is CC(=O)NCC(O[Si](C)(C)C)c1ccc(O[Si](C)(C)C)cc1.
What is the InChIKey of N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide?
The InChIKey is NJJCPMJXPFMVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO3Si2/c1-13(18)17-12-16(20-22(5,6)7)14-8-10-15(11-9-14)19-21(2,3)4/h8-11,16H,12H2,1-7H3,(H,17,18).
What are the key properties of N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide?
N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide has a molecular weight of 339.58 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-trimethylsilyloxy-2-(4-trimethylsilyloxyphenyl)ethyl]acetamide is sourced from PubChem (CID 91739849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).