2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol

C12H10N4O — CID 117128011

IUPAC2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol
SMILESNc1cccc(-c2nc3ccc(O)cn3n2)c1
InChIInChI=1S/C12H10N4O/c13-9-3-1-2-8(6-9)12-14-11-5-4-10(17)7-16(11)15-12/h1-7,17H,13H2
InChIKeyXYUVXHOXPGHECZ-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.68
Rot. Bonds1

About 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol

2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol (PubChem CID 117128011) has the molecular formula C12H10N4O and a molecular weight of 226.24 g/mol. Its IUPAC name is 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol.

Molecular Properties

Compound Name2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol
PubChem CID117128011
Molecular FormulaC12H10N4O
Molecular Weight226.24 g/mol
Exact Mass226.09
IUPAC Name2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol
SMILESNc1cccc(-c2nc3ccc(O)cn3n2)c1
InChIInChI=1S/C12H10N4O/c13-9-3-1-2-8(6-9)12-14-11-5-4-10(17)7-16(11)15-12/h1-7,17H,13H2
InChIKeyXYUVXHOXPGHECZ-UHFFFAOYSA-N
XLogP1.68
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)aniline
CID 82566376
2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol
CID 117130737
3-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 82566380
4-(7-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 136927132
6-chloro-2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117130734
[2-(3-bromophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine
CID 117130710
2-(3-chlorophenyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine
CID 163798613
3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 82566326
2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 117133013
2-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid
CID 117130740
methyl 2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylate
CID 117130742
2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 82389030

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol?
The IUPAC name of 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol (CID 117128011) is 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol.
What is the SMILES notation for 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol?
The canonical SMILES for 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol is Nc1cccc(-c2nc3ccc(O)cn3n2)c1.
What is the InChIKey of 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol?
The InChIKey is XYUVXHOXPGHECZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O/c13-9-3-1-2-8(6-9)12-14-11-5-4-10(17)7-16(11)15-12/h1-7,17H,13H2.
What are the key properties of 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol?
2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol has a molecular weight of 226.24 g/mol, XLogP of 1.68, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol is sourced from PubChem (CID 117128011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).