6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol

C12H20FNO2Si — CID 165406409

IUPAC6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol
SMILESCC(C)(C)[Si](C)(C)OCc1cc(F)c(O)cn1
InChIInChI=1S/C12H20FNO2Si/c1-12(2,3)17(4,5)16-8-9-6-10(13)11(15)7-14-9/h6-7,15H,8H2,1-5H3
InChIKeyHOOPNPILFAMPBT-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.45
Rot. Bonds3

About 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol

6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol (PubChem CID 165406409) has the molecular formula C12H20FNO2Si and a molecular weight of 257.38 g/mol. Its IUPAC name is 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol.

Molecular Properties

Compound Name6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol
PubChem CID165406409
Molecular FormulaC12H20FNO2Si
Molecular Weight257.38 g/mol
Exact Mass257.12
IUPAC Name6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol
SMILESCC(C)(C)[Si](C)(C)OCc1cc(F)c(O)cn1
InChIInChI=1S/C12H20FNO2Si/c1-12(2,3)17(4,5)16-8-9-6-10(13)11(15)7-14-9/h6-7,15H,8H2,1-5H3
InChIKeyHOOPNPILFAMPBT-UHFFFAOYSA-N
XLogP3.45
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.45
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]-4-fluoropyridin-3-ol?
The IUPAC name of 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol (CID 165406409) is 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol.
What is the SMILES notation for 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol?
The canonical SMILES for 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol is CC(C)(C)[Si](C)(C)OCc1cc(F)c(O)cn1.
What is the InChIKey of 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol?
The InChIKey is HOOPNPILFAMPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20FNO2Si/c1-12(2,3)17(4,5)16-8-9-6-10(13)11(15)7-14-9/h6-7,15H,8H2,1-5H3.
What are the key properties of 6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol?
6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-fluoropyridin-3-ol has a molecular weight of 257.38 g/mol, XLogP of 3.45, 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]-4-fluoropyridin-3-ol is sourced from PubChem (CID 165406409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).