1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol

C8H6F3N3O — CID 171537327

IUPAC1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol
SMILESCn1nc(C(F)(F)F)c2ncc(O)cc21
InChIInChI=1S/C8H6F3N3O/c1-14-5-2-4(15)3-12-6(5)7(13-14)8(9,10)11/h2-3,15H,1H3
InChIKeyXYGZXOZOPVWECZ-UHFFFAOYSA-N
MW217.15 g/mol
LogP1.69
Rot. Bonds

About 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol

1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol (PubChem CID 171537327) has the molecular formula C8H6F3N3O and a molecular weight of 217.15 g/mol. Its IUPAC name is 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol.

Molecular Properties

Compound Name1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol
PubChem CID171537327
Molecular FormulaC8H6F3N3O
Molecular Weight217.15 g/mol
Exact Mass217.05
IUPAC Name1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol
SMILESCn1nc(C(F)(F)F)c2ncc(O)cc21
InChIInChI=1S/C8H6F3N3O/c1-14-5-2-4(15)3-12-6(5)7(13-14)8(9,10)11/h2-3,15H,1H3
InChIKeyXYGZXOZOPVWECZ-UHFFFAOYSA-N
XLogP1.69
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.15
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol?
The IUPAC name of 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol (CID 171537327) is 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol.
What is the SMILES notation for 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol?
The canonical SMILES for 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol is Cn1nc(C(F)(F)F)c2ncc(O)cc21.
What is the InChIKey of 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol?
The InChIKey is XYGZXOZOPVWECZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3N3O/c1-14-5-2-4(15)3-12-6(5)7(13-14)8(9,10)11/h2-3,15H,1H3.
What are the key properties of 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol?
1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol has a molecular weight of 217.15 g/mol, XLogP of 1.69, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(trifluoromethyl)pyrazolo[4,3-b]pyridin-6-ol is sourced from PubChem (CID 171537327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).