3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol

C12H9N3O — CID 117147107

IUPAC3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol
SMILESOc1cccn2c(-c3ccccc3)nnc12
InChIInChI=1S/C12H9N3O/c16-10-7-4-8-15-11(13-14-12(10)15)9-5-2-1-3-6-9/h1-8,16H
InChIKeyTUCKHPBEZGXTGB-UHFFFAOYSA-N
MW211.22 g/mol
LogP2.10
Rot. Bonds1

About 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol

3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol (PubChem CID 117147107) has the molecular formula C12H9N3O and a molecular weight of 211.22 g/mol. Its IUPAC name is 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol.

Molecular Properties

Compound Name3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol
PubChem CID117147107
Molecular FormulaC12H9N3O
Molecular Weight211.22 g/mol
Exact Mass211.07
IUPAC Name3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol
SMILESOc1cccn2c(-c3ccccc3)nnc12
InChIInChI=1S/C12H9N3O/c16-10-7-4-8-15-11(13-14-12(10)15)9-5-2-1-3-6-9/h1-8,16H
InChIKeyTUCKHPBEZGXTGB-UHFFFAOYSA-N
XLogP2.10
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-aminophenyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117158565
(3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)methanamine
CID 82054849
4-[8-(aminomethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]phenol
CID 137006635
4-hydroxy-3,5-diphenyl-1,2,4-triazole
CID 14382453
3-phenyl-8-(2-phenylethynyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 135026654
3-[2-(dimethylamino)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147323
3-methylidenepyrrolo[2,1-c][1,2,4]triazol-7-ol
CID 163055480
5,8-diphenyl-3,4,6,7,9,10-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2,4,8,10,12,14-heptaene
CID 71482704
3-(3-bromophenyl)-8-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117147131
3-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147016
3-(8-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)aniline
CID 82058636
3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146975

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The IUPAC name of 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol (CID 117147107) is 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol.
What is the SMILES notation for 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The canonical SMILES for 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol is Oc1cccn2c(-c3ccccc3)nnc12.
What is the InChIKey of 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The InChIKey is TUCKHPBEZGXTGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O/c16-10-7-4-8-15-11(13-14-12(10)15)9-5-2-1-3-6-9/h1-8,16H.
What are the key properties of 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol has a molecular weight of 211.22 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol is sourced from PubChem (CID 117147107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).