1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol

C11H13FN4O — CID 86686988

IUPAC1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol
SMILESOC1CCN(c2nnc3ccc(F)cn23)CC1
InChIInChI=1S/C11H13FN4O/c12-8-1-2-10-13-14-11(16(10)7-8)15-5-3-9(17)4-6-15/h1-2,7,9,17H,3-6H2
InChIKeySGMYTHZICDJZOE-UHFFFAOYSA-N
MW236.25 g/mol
LogP0.83
Rot. Bonds1

About 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol

1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol (PubChem CID 86686988) has the molecular formula C11H13FN4O and a molecular weight of 236.25 g/mol. Its IUPAC name is 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol
PubChem CID86686988
Molecular FormulaC11H13FN4O
Molecular Weight236.25 g/mol
Exact Mass236.11
IUPAC Name1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol
SMILESOC1CCN(c2nnc3ccc(F)cn23)CC1
InChIInChI=1S/C11H13FN4O/c12-8-1-2-10-13-14-11(16(10)7-8)15-5-3-9(17)4-6-15/h1-2,7,9,17H,3-6H2
InChIKeySGMYTHZICDJZOE-UHFFFAOYSA-N
XLogP0.83
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol?
The IUPAC name of 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol (CID 86686988) is 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol.
What is the SMILES notation for 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol?
The canonical SMILES for 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol is OC1CCN(c2nnc3ccc(F)cn23)CC1.
What is the InChIKey of 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol?
The InChIKey is SGMYTHZICDJZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN4O/c12-8-1-2-10-13-14-11(16(10)7-8)15-5-3-9(17)4-6-15/h1-2,7,9,17H,3-6H2.
What are the key properties of 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol?
1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol has a molecular weight of 236.25 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-4-ol is sourced from PubChem (CID 86686988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).