N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide

C16H27NO4Si — CID 177442373

IUPACN-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide
SMILESCCO[Si](OCC)(OCC)c1ccc([C@H](C)NC(C)=O)cc1
InChIInChI=1S/C16H27NO4Si/c1-6-19-22(20-7-2,21-8-3)16-11-9-15(10-12-16)13(4)17-14(5)18/h9-13H,6-8H2,1-5H3,(H,17,18)/t13-/m0/s1
InChIKeyOYHQOLKRTGEBDT-ZDUSSCGKSA-N
MW325.48 g/mol
LogP2.14
Rot. Bonds9

About N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide

N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide (PubChem CID 177442373) has the molecular formula C16H27NO4Si and a molecular weight of 325.48 g/mol. Its IUPAC name is N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide
PubChem CID177442373
Molecular FormulaC16H27NO4Si
Molecular Weight325.48 g/mol
Exact Mass325.17
IUPAC NameN-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide
SMILESCCO[Si](OCC)(OCC)c1ccc([C@H](C)NC(C)=O)cc1
InChIInChI=1S/C16H27NO4Si/c1-6-19-22(20-7-2,21-8-3)16-11-9-15(10-12-16)13(4)17-14(5)18/h9-13H,6-8H2,1-5H3,(H,17,18)/t13-/m0/s1
InChIKeyOYHQOLKRTGEBDT-ZDUSSCGKSA-N
XLogP2.14
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.48
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide
CID 56706704
N-[1-[4-[2-(6-ethoxypyrimidin-4-yl)ethynyl]phenyl]ethyl]acetamide
CID 66634854
4-[(1R)-1-acetamidoethyl]benzamide
CID 175730971
N-[1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]acetamide
CID 68813957
N-[(1S)-1-(4-butylselanylphenyl)ethyl]acetamide
CID 46209707
N-[(1R)-1-[4-[(2S)-2-chloropropanoyl]phenyl]ethyl]acetamide
CID 124500379
N-[(1S)-1-(6-methyl-3-pyridinyl)ethyl]acetamide
CID 100987523
N-[(1R)-1-[4-[6-(4-propoxyphenoxy)-3-pyridinyl]phenyl]ethyl]acetamide
CID 45487729
carbon monoxide;chromium;N-[(1R)-1-phenylethyl]acetamide
CID 14362564
N-[1-[4-[1-(6-ethoxypyrimidin-4-yl)azetidin-3-yl]oxyphenyl]ethyl]acetamide
CID 123494234
N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide
CID 68760589
N-[1-[4-[1-(4-ethoxyphenyl)pyrrolidin-3-yl]oxyphenyl]ethyl]acetamide
CID 123377438

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide?
The IUPAC name of N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide (CID 177442373) is N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide?
The canonical SMILES for N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide is CCO[Si](OCC)(OCC)c1ccc([C@H](C)NC(C)=O)cc1.
What is the InChIKey of N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide?
The InChIKey is OYHQOLKRTGEBDT-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H27NO4Si/c1-6-19-22(20-7-2,21-8-3)16-11-9-15(10-12-16)13(4)17-14(5)18/h9-13H,6-8H2,1-5H3,(H,17,18)/t13-/m0/s1.
What are the key properties of N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide?
N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide has a molecular weight of 325.48 g/mol, XLogP of 2.14, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-triethoxysilylphenyl)ethyl]acetamide is sourced from PubChem (CID 177442373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).