O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine

C15H27NO2Si — CID 71251740

IUPACO-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine
SMILESCC(C)(C)[Si](C)(C)OCCC(ON)c1ccccc1
InChIInChI=1S/C15H27NO2Si/c1-15(2,3)19(4,5)17-12-11-14(18-16)13-9-7-6-8-10-13/h6-10,14H,11-12,16H2,1-5H3
InChIKeyJRRUNOQQRAFIDH-UHFFFAOYSA-N
MW281.47 g/mol
LogP4.03
Rot. Bonds6

About O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine

O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine (PubChem CID 71251740) has the molecular formula C15H27NO2Si and a molecular weight of 281.47 g/mol. Its IUPAC name is O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine.

Molecular Properties

Compound NameO-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine
PubChem CID71251740
Molecular FormulaC15H27NO2Si
Molecular Weight281.47 g/mol
Exact Mass281.18
IUPAC NameO-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine
SMILESCC(C)(C)[Si](C)(C)OCCC(ON)c1ccccc1
InChIInChI=1S/C15H27NO2Si/c1-15(2,3)19(4,5)17-12-11-14(18-16)13-9-7-6-8-10-13/h6-10,14H,11-12,16H2,1-5H3
InChIKeyJRRUNOQQRAFIDH-UHFFFAOYSA-N
XLogP4.03
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[8-[tert-butyl(dimethyl)silyl]oxy-1-phenyloctoxy]-dimethylsilane
CID 10789748
(2R)-4-[tert-butyl(dimethyl)silyl]oxy-1-phenylbutane-1,2-diol
CID 175760972
(1R,2S,3R)-5-[tert-butyl(dimethyl)silyl]oxy-1-phenylpentane-1,2,3-triol
CID 10853609
tert-butyl-(3-dimethoxyphosphoryl-3-phenylpropoxy)-dimethylsilane
CID 15108858
2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethanamine
CID 11459395
14-[tert-butyl(dimethyl)silyl]oxy-2-(2,2-diphenylacetyl)oxytetradecanoic acid
CID 67997848
2-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]ethanol
CID 59001710
benzyl (2R)-4-[tert-butyl(dimethyl)silyl]oxy-2-(2,2-diphenylacetyl)oxybutanoate
CID 46179798
tert-butyl-dimethyl-(2-phenylsulfanylethoxy)silane
CID 11346217
O-(3-amino-1-phenylpropyl)hydroxylamine
CID 58171394
tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
(1S)-5-[tert-butyl(dimethyl)silyl]oxy-N,N-dimethyl-1-phenylpentane-1-sulfonamide
CID 91798381

Frequently Asked Questions

What is the IUPAC name of O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine?
The IUPAC name of O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine (CID 71251740) is O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine.
What is the SMILES notation for O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine?
The canonical SMILES for O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine is CC(C)(C)[Si](C)(C)OCCC(ON)c1ccccc1.
What is the InChIKey of O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine?
The InChIKey is JRRUNOQQRAFIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2Si/c1-15(2,3)19(4,5)17-12-11-14(18-16)13-9-7-6-8-10-13/h6-10,14H,11-12,16H2,1-5H3.
What are the key properties of O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine?
O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine has a molecular weight of 281.47 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[3-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropyl]hydroxylamine is sourced from PubChem (CID 71251740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).