5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid

C13H11N5O2 — CID 135304843

IUPAC5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid
SMILESCc1ncc(C(=O)O)cc1-c1ccn2nc(N)nc2c1
InChIInChI=1S/C13H11N5O2/c1-7-10(4-9(6-15-7)12(19)20)8-2-3-18-11(5-8)16-13(14)17-18/h2-6H,1H3,(H2,14,17)(H,19,20)
InChIKeyHNSFYDQUKTWIBA-UHFFFAOYSA-N
MW269.26 g/mol
LogP1.38
Rot. Bonds2

About 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid

5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid (PubChem CID 135304843) has the molecular formula C13H11N5O2 and a molecular weight of 269.26 g/mol. Its IUPAC name is 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid
PubChem CID135304843
Molecular FormulaC13H11N5O2
Molecular Weight269.26 g/mol
Exact Mass269.09
IUPAC Name5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid
SMILESCc1ncc(C(=O)O)cc1-c1ccn2nc(N)nc2c1
InChIInChI=1S/C13H11N5O2/c1-7-10(4-9(6-15-7)12(19)20)8-2-3-18-11(5-8)16-13(14)17-18/h2-6H,1H3,(H2,14,17)(H,19,20)
InChIKeyHNSFYDQUKTWIBA-UHFFFAOYSA-N
XLogP1.38
TPSA106.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-fluoro-2-methylbenzoic acid
CID 169003892
3-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-chloro-2-fluorobenzoic acid
CID 169003972
CID 175967095
CID 175967095
3-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2,4-difluorobenzoic acid
CID 169003930
3-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-chloro-2-fluorobenzoic acid;hydrochloride
CID 169224460
3-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-fluoro-6-methylphenol
CID 176959826
ethyl 2-amino-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 121232268
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-chloro-N-[(1S)-1-[2-fluoro-5-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide
CID 150943548
7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82556367
1-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methyl-3-pyridinyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]butan-1-one
CID 157444574
methyl 3-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-ethenyl-2-fluorobenzoate
CID 169003913
7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82556371

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid?
The IUPAC name of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid (CID 135304843) is 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid.
What is the SMILES notation for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid?
The canonical SMILES for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid is Cc1ncc(C(=O)O)cc1-c1ccn2nc(N)nc2c1.
What is the InChIKey of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid?
The InChIKey is HNSFYDQUKTWIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O2/c1-7-10(4-9(6-15-7)12(19)20)8-2-3-18-11(5-8)16-13(14)17-18/h2-6H,1H3,(H2,14,17)(H,19,20).
What are the key properties of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid?
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid has a molecular weight of 269.26 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-6-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 135304843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).