6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol

C16H27NO2Si — CID 134856695

IUPAC6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol
SMILESCC(C)(C)[Si](C)(C)OCC1Cc2cccnc2C(O)C1
InChIInChI=1S/C16H27NO2Si/c1-16(2,3)20(4,5)19-11-12-9-13-7-6-8-17-15(13)14(18)10-12/h6-8,12,14,18H,9-11H2,1-5H3
InChIKeyPFELECLNXOEZEP-UHFFFAOYSA-N
MW293.48 g/mol
LogP3.70
Rot. Bonds3

About 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol

6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol (PubChem CID 134856695) has the molecular formula C16H27NO2Si and a molecular weight of 293.48 g/mol. Its IUPAC name is 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol.

Molecular Properties

Compound Name6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol
PubChem CID134856695
Molecular FormulaC16H27NO2Si
Molecular Weight293.48 g/mol
Exact Mass293.18
IUPAC Name6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol
SMILESCC(C)(C)[Si](C)(C)OCC1Cc2cccnc2C(O)C1
InChIInChI=1S/C16H27NO2Si/c1-16(2,3)20(4,5)19-11-12-9-13-7-6-8-17-15(13)14(18)10-12/h6-8,12,14,18H,9-11H2,1-5H3
InChIKeyPFELECLNXOEZEP-UHFFFAOYSA-N
XLogP3.70
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 ≤ 53.70
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 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol?
The IUPAC name of 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol (CID 134856695) is 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol.
What is the SMILES notation for 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol?
The canonical SMILES for 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol is CC(C)(C)[Si](C)(C)OCC1Cc2cccnc2C(O)C1.
What is the InChIKey of 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol?
The InChIKey is PFELECLNXOEZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2Si/c1-16(2,3)20(4,5)19-11-12-9-13-7-6-8-17-15(13)14(18)10-12/h6-8,12,14,18H,9-11H2,1-5H3.
What are the key properties of 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol?
6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol has a molecular weight of 293.48 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-5,6,7,8-tetrahydroquinolin-8-ol is sourced from PubChem (CID 134856695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).