1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol

C12H13F3N2O2 — CID 59389385

IUPAC1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol
SMILESCCC(O)c1ccc(OC)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C12H13F3N2O2/c1-3-9(18)7-4-5-11(19-2)17-8(7)6-10(16-17)12(13,14)15/h4-6,9,18H,3H2,1-2H3
InChIKeyZYTHTAIBIKYXGZ-UHFFFAOYSA-N
MW274.24 g/mol
LogP2.81
Rot. Bonds3

About 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol

1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol (PubChem CID 59389385) has the molecular formula C12H13F3N2O2 and a molecular weight of 274.24 g/mol. Its IUPAC name is 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol.

Molecular Properties

Compound Name1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol
PubChem CID59389385
Molecular FormulaC12H13F3N2O2
Molecular Weight274.24 g/mol
Exact Mass274.09
IUPAC Name1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol
SMILESCCC(O)c1ccc(OC)n2nc(C(F)(F)F)cc12
InChIInChI=1S/C12H13F3N2O2/c1-3-9(18)7-4-5-11(19-2)17-8(7)6-10(16-17)12(13,14)15/h4-6,9,18H,3H2,1-2H3
InChIKeyZYTHTAIBIKYXGZ-UHFFFAOYSA-N
XLogP2.81
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.24
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol?
The IUPAC name of 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol (CID 59389385) is 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol.
What is the SMILES notation for 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol?
The canonical SMILES for 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol is CCC(O)c1ccc(OC)n2nc(C(F)(F)F)cc12.
What is the InChIKey of 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol?
The InChIKey is ZYTHTAIBIKYXGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N2O2/c1-3-9(18)7-4-5-11(19-2)17-8(7)6-10(16-17)12(13,14)15/h4-6,9,18H,3H2,1-2H3.
What are the key properties of 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol?
1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol has a molecular weight of 274.24 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[7-methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]propan-1-ol is sourced from PubChem (CID 59389385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).