3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol

C13H11N3O — CID 82566326

IUPAC3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
SMILESCc1ccn2nc(-c3cccc(O)c3)nc2c1
InChIInChI=1S/C13H11N3O/c1-9-5-6-16-12(7-9)14-13(15-16)10-3-2-4-11(17)8-10/h2-8,17H,1H3
InChIKeyYDEBKUYCOPSHQV-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.41
Rot. Bonds1

About 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol

3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol (PubChem CID 82566326) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol.

Molecular Properties

Compound Name3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
PubChem CID82566326
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
SMILESCc1ccn2nc(-c3cccc(O)c3)nc2c1
InChIInChI=1S/C13H11N3O/c1-9-5-6-16-12(7-9)14-13(15-16)10-3-2-4-11(17)8-10/h2-8,17H,1H3
InChIKeyYDEBKUYCOPSHQV-UHFFFAOYSA-N
XLogP2.41
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
The IUPAC name of 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol (CID 82566326) is 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol.
What is the SMILES notation for 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
The canonical SMILES for 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol is Cc1ccn2nc(-c3cccc(O)c3)nc2c1.
What is the InChIKey of 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
The InChIKey is YDEBKUYCOPSHQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-9-5-6-16-12(7-9)14-13(15-16)10-3-2-4-11(17)8-10/h2-8,17H,1H3.
What are the key properties of 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol has a molecular weight of 225.25 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol is sourced from PubChem (CID 82566326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).