3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol

C13H10FN3O — CID 117146975

IUPAC3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
SMILESOc1cccn2c(Cc3ccccc3F)nnc12
InChIInChI=1S/C13H10FN3O/c14-10-5-2-1-4-9(10)8-12-15-16-13-11(18)6-3-7-17(12)13/h1-7,18H,8H2
InChIKeyVGQYZQXNMAQGLO-UHFFFAOYSA-N
MW243.24 g/mol
LogP2.16
Rot. Bonds2

About 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol

3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol (PubChem CID 117146975) has the molecular formula C13H10FN3O and a molecular weight of 243.24 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
PubChem CID117146975
Molecular FormulaC13H10FN3O
Molecular Weight243.24 g/mol
Exact Mass243.08
IUPAC Name3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
SMILESOc1cccn2c(Cc3ccccc3F)nnc12
InChIInChI=1S/C13H10FN3O/c14-10-5-2-1-4-9(10)8-12-15-16-13-11(18)6-3-7-17(12)13/h1-7,18H,8H2
InChIKeyVGQYZQXNMAQGLO-UHFFFAOYSA-N
XLogP2.16
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 117147696
2-[(8-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]phenol
CID 117146993
3-[(2-fluorophenyl)methyl]-N-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine;hydrochloride
CID 19906261
3-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147016
3-[(3-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146892
3-[(2-chlorophenyl)methyl]-8-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117146970
3-[(2-fluorophenyl)methyl]-6-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117139612
3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
CID 62389506
3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146178
3-[(1,1-dioxothian-4-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146384
3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine-8-carbaldehyde
CID 117146101
3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147107

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The IUPAC name of 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol (CID 117146975) is 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol.
What is the SMILES notation for 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The canonical SMILES for 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol is Oc1cccn2c(Cc3ccccc3F)nnc12.
What is the InChIKey of 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The InChIKey is VGQYZQXNMAQGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3O/c14-10-5-2-1-4-9(10)8-12-15-16-13-11(18)6-3-7-17(12)13/h1-7,18H,8H2.
What are the key properties of 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol has a molecular weight of 243.24 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol is sourced from PubChem (CID 117146975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).