2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid

C20H27NO3Si — CID 67674585

IUPAC2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid
SMILESCC(C)(C)[Si](OCCNCC(=O)O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H27NO3Si/c1-20(2,3)25(17-10-6-4-7-11-17,18-12-8-5-9-13-18)24-15-14-21-16-19(22)23/h4-13,21H,14-16H2,1-3H3,(H,22,23)
InChIKeyHMNIXSNBCLLFMH-UHFFFAOYSA-N
MW357.53 g/mol
LogP2.24
Rot. Bonds8

About 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid

2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid (PubChem CID 67674585) has the molecular formula C20H27NO3Si and a molecular weight of 357.53 g/mol. Its IUPAC name is 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid.

Molecular Properties

Compound Name2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid
PubChem CID67674585
Molecular FormulaC20H27NO3Si
Molecular Weight357.53 g/mol
Exact Mass357.18
IUPAC Name2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid
SMILESCC(C)(C)[Si](OCCNCC(=O)O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H27NO3Si/c1-20(2,3)25(17-10-6-4-7-11-17,18-12-8-5-9-13-18)24-15-14-21-16-19(22)23/h4-13,21H,14-16H2,1-3H3,(H,22,23)
InChIKeyHMNIXSNBCLLFMH-UHFFFAOYSA-N
XLogP2.24
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.53
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

(2S)-2-amino-3-[tert-butyl(diphenyl)silyl]oxypropanoic acid
CID 16753285
(2S)-2-[3-[tert-butyl(diphenyl)silyl]oxypropylamino]propan-1-ol;2,2,2-trifluoroacetic acid
CID 176319833
(5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]morpholin-2-one
CID 134972742
(2S)-2-(tert-butylazaniumyl)-2-diphenylphosphanylacetate;methanol
CID 139179681
2-(tert-butyldiphenylsilyloxy)-N-methylethanamine
CID 11823158
2-[2-[Tert-butyl(diphenyl)silyl]oxyethylamino]ethanol
CID 20591828
N-[2-[[(1,1-dimethylethyl)diphenylsilyl]oxy]ethyl]-2-propanamine
CID 21669252
2-[Tert-butyl(diphenyl)silyl]oxyethylcarbamic acid
CID 22242877
N-[2-[[(1,1-Dimethylethyl)diphenylsilyl]oxy]ethyl]glycine 1,1-dimethylethyl ester
CID 54084825
2-(tert-butyldiphenylsilyloxy)-N-ethylethanamine
CID 58080159
N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]propan-1-amine
CID 58080170
[[(2R)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]amino]methanol
CID 58715062

Frequently Asked Questions

What is the IUPAC name of 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid?
The IUPAC name of 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid (CID 67674585) is 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid.
What is the SMILES notation for 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid?
The canonical SMILES for 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid is CC(C)(C)[Si](OCCNCC(=O)O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid?
The InChIKey is HMNIXSNBCLLFMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27NO3Si/c1-20(2,3)25(17-10-6-4-7-11-17,18-12-8-5-9-13-18)24-15-14-21-16-19(22)23/h4-13,21H,14-16H2,1-3H3,(H,22,23).
What are the key properties of 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid?
2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid has a molecular weight of 357.53 g/mol, XLogP of 2.24, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[tert-butyl(diphenyl)silyl]oxyethylamino]acetic acid is sourced from PubChem (CID 67674585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).