2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid

C13H9FN4O2 — CID 82556781

IUPAC2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
SMILESNc1nc2cc(C(=O)O)c(-c3ccccc3F)cn2n1
InChIInChI=1S/C13H9FN4O2/c14-10-4-2-1-3-7(10)9-6-18-11(16-13(15)17-18)5-8(9)12(19)20/h1-6H,(H2,15,17)(H,19,20)
InChIKeyWYXXQAUIDGJRMV-UHFFFAOYSA-N
MW272.24 g/mol
LogP1.82
Rot. Bonds2

About 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid

2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid (PubChem CID 82556781) has the molecular formula C13H9FN4O2 and a molecular weight of 272.24 g/mol. Its IUPAC name is 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
PubChem CID82556781
Molecular FormulaC13H9FN4O2
Molecular Weight272.24 g/mol
Exact Mass272.07
IUPAC Name2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
SMILESNc1nc2cc(C(=O)O)c(-c3ccccc3F)cn2n1
InChIInChI=1S/C13H9FN4O2/c14-10-4-2-1-3-7(10)9-6-18-11(16-13(15)17-18)5-8(9)12(19)20/h1-6H,(H2,15,17)(H,19,20)
InChIKeyWYXXQAUIDGJRMV-UHFFFAOYSA-N
XLogP1.82
TPSA93.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.24
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-6-(2-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82556787
2-amino-6-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82556780
2-amino-6-(5-fluoro-2-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82555680
2-amino-6-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82556809
2-amino-6-(2-methoxy-5-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82555678
2-amino-6-(4-phenylmethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82555687
3-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2,4-difluorobenzoic acid
CID 169003930
3-(2-fluorophenyl)naphthalene-2-carboxylic acid
CID 171127463
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-fluoro-2-methylbenzoic acid
CID 169003892
2-amino-6-(2-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82556725
2-amino-6-(3-fluoro-4-hydroxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82556745
4-(2-fluorophenyl)phthalic acid
CID 71119653

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid?
The IUPAC name of 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid (CID 82556781) is 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid.
What is the SMILES notation for 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid?
The canonical SMILES for 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid is Nc1nc2cc(C(=O)O)c(-c3ccccc3F)cn2n1.
What is the InChIKey of 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid?
The InChIKey is WYXXQAUIDGJRMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN4O2/c14-10-4-2-1-3-7(10)9-6-18-11(16-13(15)17-18)5-8(9)12(19)20/h1-6H,(H2,15,17)(H,19,20).
What are the key properties of 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid?
2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid has a molecular weight of 272.24 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 82556781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).