[5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol

C16H27NO2Si — CID 163390764

IUPAC[5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC1CCCc2nc(CO)ccc21
InChIInChI=1S/C16H27NO2Si/c1-16(2,3)20(4,5)19-15-8-6-7-14-13(15)10-9-12(11-18)17-14/h9-10,15,18H,6-8,11H2,1-5H3
InChIKeyBPZCPFLTBGLQDE-UHFFFAOYSA-N
MW293.48 g/mol
LogP3.97
Rot. Bonds3

About [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol

[5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol (PubChem CID 163390764) has the molecular formula C16H27NO2Si and a molecular weight of 293.48 g/mol. Its IUPAC name is [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol.

Molecular Properties

Compound Name[5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol
PubChem CID163390764
Molecular FormulaC16H27NO2Si
Molecular Weight293.48 g/mol
Exact Mass293.18
IUPAC Name[5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC1CCCc2nc(CO)ccc21
InChIInChI=1S/C16H27NO2Si/c1-16(2,3)20(4,5)19-15-8-6-7-14-13(15)10-9-12(11-18)17-14/h9-10,15,18H,6-8,11H2,1-5H3
InChIKeyBPZCPFLTBGLQDE-UHFFFAOYSA-N
XLogP3.97
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.48
LogP ≤ 53.97
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

[5-[tert-butyl(dimethyl)silyl]oxy-4-(4-fluorophenyl)-2-propan-2-yl-5,6,7,8-tetrahydroquinolin-3-yl]methanol
CID 22011987
9-[tert-butyl(dimethyl)silyl]oxy-2-chloro-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
CID 71282049
tert-butyl-dimethyl-(2,3,4,5-tetrahydro-1H-1-benzazepin-5-yloxy)silane
CID 69220700
[(3S)-3-[tert-butyl(dimethyl)silyl]oxycyclopenten-1-yl]methanol
CID 46193781
[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]-cyclobutylmethanol
CID 67812161
N-[[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-5-yl]methylidene]hydroxylamine
CID 150629221
tert-butyl-dimethyl-[(2-tributylstannyl-4,5,6,7-tetrahydro-1-benzofuran-4-yl)oxy]silane
CID 59889267
1-[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]-1,1-difluoro-2-methylpropan-2-ol
CID 77360299
tert-butyl-dimethyl-[(4-methylidene-2,3-dihydro-1H-naphthalen-1-yl)oxy]silane
CID 134980286
2-[tert-butyl(dimethyl)silyl]oxycycloheptan-1-one
CID 14396580
[5-[tert-butyl(dimethyl)silyl]oxy-4-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-2-propan-2-yl-5,6,7,8-tetrahydroquinolin-3-yl]methanol
CID 21334070
1-[1-[tert-butyl(dimethyl)silyl]oxy-2,3-dihydro-1H-inden-4-yl]pent-4-en-1-one
CID 123160452

Frequently Asked Questions

What is the IUPAC name of [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol?
The IUPAC name of [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol (CID 163390764) is [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol.
What is the SMILES notation for [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol?
The canonical SMILES for [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol is CC(C)(C)[Si](C)(C)OC1CCCc2nc(CO)ccc21.
What is the InChIKey of [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol?
The InChIKey is BPZCPFLTBGLQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2Si/c1-16(2,3)20(4,5)19-15-8-6-7-14-13(15)10-9-12(11-18)17-14/h9-10,15,18H,6-8,11H2,1-5H3.
What are the key properties of [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol?
[5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol has a molecular weight of 293.48 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[tert-butyl(dimethyl)silyl]oxy-5,6,7,8-tetrahydroquinolin-2-yl]methanol is sourced from PubChem (CID 163390764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).