2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane

C13H19F2N3OSi — CID 169159872

IUPAC2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1nc(C(F)F)c2ccncc21
InChIInChI=1S/C13H19F2N3OSi/c1-20(2,3)7-6-19-9-18-11-8-16-5-4-10(11)12(17-18)13(14)15/h4-5,8,13H,6-7,9H2,1-3H3
InChIKeyIYVOLIGPDNSBBU-UHFFFAOYSA-N
MW299.40 g/mol
LogP3.68
Rot. Bonds6

About 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane

2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 169159872) has the molecular formula C13H19F2N3OSi and a molecular weight of 299.40 g/mol. Its IUPAC name is 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane
PubChem CID169159872
Molecular FormulaC13H19F2N3OSi
Molecular Weight299.40 g/mol
Exact Mass299.13
IUPAC Name2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1nc(C(F)F)c2ccncc21
InChIInChI=1S/C13H19F2N3OSi/c1-20(2,3)7-6-19-9-18-11-8-16-5-4-10(11)12(17-18)13(14)15/h4-5,8,13H,6-7,9H2,1-3H3
InChIKeyIYVOLIGPDNSBBU-UHFFFAOYSA-N
XLogP3.68
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane (CID 169159872) is 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCn1nc(C(F)F)c2ccncc21.
What is the InChIKey of 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane?
The InChIKey is IYVOLIGPDNSBBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19F2N3OSi/c1-20(2,3)7-6-19-9-18-11-8-16-5-4-10(11)12(17-18)13(14)15/h4-5,8,13H,6-7,9H2,1-3H3.
What are the key properties of 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane?
2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 299.40 g/mol, XLogP of 3.68, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(difluoromethyl)pyrazolo[5,4-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 169159872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).