(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol

C7H6FN3O — CID 105433265

IUPAC(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol
SMILESOCc1nnc2cccc(F)n12
InChIInChI=1S/C7H6FN3O/c8-5-2-1-3-6-9-10-7(4-12)11(5)6/h1-3,12H,4H2
InChIKeyKCSYJRQFLYWGQN-UHFFFAOYSA-N
MW167.14 g/mol
LogP0.36
Rot. Bonds1

About (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol

(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol (PubChem CID 105433265) has the molecular formula C7H6FN3O and a molecular weight of 167.14 g/mol. Its IUPAC name is (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol.

Molecular Properties

Compound Name(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol
PubChem CID105433265
Molecular FormulaC7H6FN3O
Molecular Weight167.14 g/mol
Exact Mass167.05
IUPAC Name(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol
SMILESOCc1nnc2cccc(F)n12
InChIInChI=1S/C7H6FN3O/c8-5-2-1-3-6-9-10-7(4-12)11(5)6/h1-3,12H,4H2
InChIKeyKCSYJRQFLYWGQN-UHFFFAOYSA-N
XLogP0.36
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.14
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)propan-1-amine
CID 105447953
(9-fluoro-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)methanol
CID 115038111
(5-fluoroimidazo[1,2-a]pyridin-2-yl)methanol
CID 53485251
1-(hydroxymethyl)-[1,2,4]triazolo[4,3-a]quinolin-7-ol
CID 115028975
3,5-diethyl-[1,2,4]triazolo[4,3-a]pyridine
CID 66849171
3-[(4-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-5-carbaldehyde
CID 117141154
2-(9-fluoro-[1,2,4]triazolo[4,3-a]quinolin-1-yl)ethanamine
CID 115037655
(5-chloro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)methanol
CID 81441170
(5-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanethiol
CID 117257045
2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 21265826
3-[(3-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylic acid
CID 117142753
[5-(2-fluoro-3-methylphenyl)-4-methyl-1,2,4-triazol-3-yl]methanol
CID 115397022

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol?
The IUPAC name of (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol (CID 105433265) is (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol.
What is the SMILES notation for (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol?
The canonical SMILES for (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol is OCc1nnc2cccc(F)n12.
What is the InChIKey of (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol?
The InChIKey is KCSYJRQFLYWGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6FN3O/c8-5-2-1-3-6-9-10-7(4-12)11(5)6/h1-3,12H,4H2.
What are the key properties of (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol?
(5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol has a molecular weight of 167.14 g/mol, XLogP of 0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanol is sourced from PubChem (CID 105433265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).