(8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol

C16H27NO2Si — CID 23157012

IUPAC(8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol
SMILESCC[Si](CC)(CC)OC1CC(CO)Cc2cccnc21
InChIInChI=1S/C16H27NO2Si/c1-4-20(5-2,6-3)19-15-11-13(12-18)10-14-8-7-9-17-16(14)15/h7-9,13,15,18H,4-6,10-12H2,1-3H3
InChIKeyNIPAUICFVIMWMD-UHFFFAOYSA-N
MW293.48 g/mol
LogP3.70
Rot. Bonds6

About (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol

(8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol (PubChem CID 23157012) has the molecular formula C16H27NO2Si and a molecular weight of 293.48 g/mol. Its IUPAC name is (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol.

Molecular Properties

Compound Name(8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol
PubChem CID23157012
Molecular FormulaC16H27NO2Si
Molecular Weight293.48 g/mol
Exact Mass293.18
IUPAC Name(8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol
SMILESCC[Si](CC)(CC)OC1CC(CO)Cc2cccnc21
InChIInChI=1S/C16H27NO2Si/c1-4-20(5-2,6-3)19-15-11-13(12-18)10-14-8-7-9-17-16(14)15/h7-9,13,15,18H,4-6,10-12H2,1-3H3
InChIKeyNIPAUICFVIMWMD-UHFFFAOYSA-N
XLogP3.70
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.48
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol?
The IUPAC name of (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol (CID 23157012) is (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol.
What is the SMILES notation for (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol?
The canonical SMILES for (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol is CC[Si](CC)(CC)OC1CC(CO)Cc2cccnc21.
What is the InChIKey of (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol?
The InChIKey is NIPAUICFVIMWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2Si/c1-4-20(5-2,6-3)19-15-11-13(12-18)10-14-8-7-9-17-16(14)15/h7-9,13,15,18H,4-6,10-12H2,1-3H3.
What are the key properties of (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol?
(8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol has a molecular weight of 293.48 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-triethylsilyloxy-5,6,7,8-tetrahydroquinolin-6-yl)methanol is sourced from PubChem (CID 23157012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).