[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol

C16H23F3N2O2Si — CID 58013985

IUPAC[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(CO)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C16H23F3N2O2Si/c1-15(2,3)24(4,5)23-10-11-6-7-12(9-22)21-13(11)8-14(20-21)16(17,18)19/h6-8,22H,9-10H2,1-5H3
InChIKeyBZDAMQIXRAMMHI-UHFFFAOYSA-N
MW360.45 g/mol
LogP4.37
Rot. Bonds4

About [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol

[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol (PubChem CID 58013985) has the molecular formula C16H23F3N2O2Si and a molecular weight of 360.45 g/mol. Its IUPAC name is [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol
PubChem CID58013985
Molecular FormulaC16H23F3N2O2Si
Molecular Weight360.45 g/mol
Exact Mass360.15
IUPAC Name[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(CO)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C16H23F3N2O2Si/c1-15(2,3)24(4,5)23-10-11-6-7-12(9-22)21-13(11)8-14(20-21)16(17,18)19/h6-8,22H,9-10H2,1-5H3
InChIKeyBZDAMQIXRAMMHI-UHFFFAOYSA-N
XLogP4.37
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.45
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol?
The IUPAC name of [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol (CID 58013985) is [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol.
What is the SMILES notation for [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol?
The canonical SMILES for [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol is CC(C)(C)[Si](C)(C)OCc1ccc(CO)n2nc(C(F)(F)F)cc12.
What is the InChIKey of [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol?
The InChIKey is BZDAMQIXRAMMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23F3N2O2Si/c1-15(2,3)24(4,5)23-10-11-6-7-12(9-22)21-13(11)8-14(20-21)16(17,18)19/h6-8,22H,9-10H2,1-5H3.
What are the key properties of [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol?
[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol has a molecular weight of 360.45 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-7-yl]methanol is sourced from PubChem (CID 58013985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).