2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol

C10H11F3N4O — CID 16672499

IUPAC2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol
SMILESCc1cc(C(F)(F)F)c2c(N)nn(CCO)c2n1
InChIInChI=1S/C10H11F3N4O/c1-5-4-6(10(11,12)13)7-8(14)16-17(2-3-18)9(7)15-5/h4,18H,2-3H2,1H3,(H2,14,16)
InChIKeyPDBFRNJFHODEAN-UHFFFAOYSA-N
MW260.22 g/mol
LogP1.33
Rot. Bonds2

About 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol

2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol (PubChem CID 16672499) has the molecular formula C10H11F3N4O and a molecular weight of 260.22 g/mol. Its IUPAC name is 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol
PubChem CID16672499
Molecular FormulaC10H11F3N4O
Molecular Weight260.22 g/mol
Exact Mass260.09
IUPAC Name2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol
SMILESCc1cc(C(F)(F)F)c2c(N)nn(CCO)c2n1
InChIInChI=1S/C10H11F3N4O/c1-5-4-6(10(11,12)13)7-8(14)16-17(2-3-18)9(7)15-5/h4,18H,2-3H2,1H3,(H2,14,16)
InChIKeyPDBFRNJFHODEAN-UHFFFAOYSA-N
XLogP1.33
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.22
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol?
The IUPAC name of 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol (CID 16672499) is 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol.
What is the SMILES notation for 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol?
The canonical SMILES for 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol is Cc1cc(C(F)(F)F)c2c(N)nn(CCO)c2n1.
What is the InChIKey of 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol?
The InChIKey is PDBFRNJFHODEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N4O/c1-5-4-6(10(11,12)13)7-8(14)16-17(2-3-18)9(7)15-5/h4,18H,2-3H2,1H3,(H2,14,16).
What are the key properties of 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol?
2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol has a molecular weight of 260.22 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-amino-6-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]ethanol is sourced from PubChem (CID 16672499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).