(2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol

C13H11FN4O — CID 67343283

IUPAC(2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol
SMILESNc1nc2c(C(O)c3ccc(F)cc3)cccn2n1
InChIInChI=1S/C13H11FN4O/c14-9-5-3-8(4-6-9)11(19)10-2-1-7-18-12(10)16-13(15)17-18/h1-7,11,19H,(H2,15,17)
InChIKeyYPQPBFSHYRQVTD-UHFFFAOYSA-N
MW258.26 g/mol
LogP1.53
Rot. Bonds2

About (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol

(2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol (PubChem CID 67343283) has the molecular formula C13H11FN4O and a molecular weight of 258.26 g/mol. Its IUPAC name is (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol
PubChem CID67343283
Molecular FormulaC13H11FN4O
Molecular Weight258.26 g/mol
Exact Mass258.09
IUPAC Name(2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol
SMILESNc1nc2c(C(O)c3ccc(F)cc3)cccn2n1
InChIInChI=1S/C13H11FN4O/c14-9-5-3-8(4-6-9)11(19)10-2-1-7-18-12(10)16-13(15)17-18/h1-7,11,19H,(H2,15,17)
InChIKeyYPQPBFSHYRQVTD-UHFFFAOYSA-N
XLogP1.53
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.26
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol?
The IUPAC name of (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol (CID 67343283) is (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol.
What is the SMILES notation for (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol?
The canonical SMILES for (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol is Nc1nc2c(C(O)c3ccc(F)cc3)cccn2n1.
What is the InChIKey of (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol?
The InChIKey is YPQPBFSHYRQVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4O/c14-9-5-3-8(4-6-9)11(19)10-2-1-7-18-12(10)16-13(15)17-18/h1-7,11,19H,(H2,15,17).
What are the key properties of (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol?
(2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol has a molecular weight of 258.26 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-(4-fluorophenyl)methanol is sourced from PubChem (CID 67343283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).