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

C13H12N4O2 — CID 117257264

IUPAC2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol
SMILESNc1ccn2c(COc3ccccc3O)nnc2c1
InChIInChI=1S/C13H12N4O2/c14-9-5-6-17-12(7-9)15-16-13(17)8-19-11-4-2-1-3-10(11)18/h1-7,18H,8,14H2
InChIKeyICYVDCAWKFSZTF-UHFFFAOYSA-N
MW256.26 g/mol
LogP1.60
Rot. Bonds3

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

2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol (PubChem CID 117257264) has the molecular formula C13H12N4O2 and a molecular weight of 256.26 g/mol. Its IUPAC name is 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol.

Molecular Properties

Compound Name2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol
PubChem CID117257264
Molecular FormulaC13H12N4O2
Molecular Weight256.26 g/mol
Exact Mass256.10
IUPAC Name2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol
SMILESNc1ccn2c(COc3ccccc3O)nnc2c1
InChIInChI=1S/C13H12N4O2/c14-9-5-6-17-12(7-9)15-16-13(17)8-19-11-4-2-1-3-10(11)18/h1-7,18H,8,14H2
InChIKeyICYVDCAWKFSZTF-UHFFFAOYSA-N
XLogP1.60
TPSA85.67 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol with MolForge

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Related Compounds

7-chloro-3-[(2-methylphenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117257259
3-[(2-methylphenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117256976
4-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethoxy)phenol
CID 117257025
2-[(5-aminoimidazo[1,2-a]pyridin-2-yl)methoxy]phenol
CID 117255734
3-(phenoxymethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117256973
3-[(3-fluorophenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 117257148
3-(piperidin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-7-amine
CID 117143951
3-[[4-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[4,3-a]pyridin-7-amine
CID 117144561
7-chloro-3-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117257284
2-[(5-amino-1H-imidazol-2-yl)methoxy]phenol
CID 117187252
methyl 3-[(3-hydroxyphenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylate
CID 117257343
2-[(5-amino-1-ethylindol-2-yl)methoxy]phenol
CID 117177231

Frequently Asked Questions

What is the IUPAC name of 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol?
The IUPAC name of 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol (CID 117257264) is 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol.
What is the SMILES notation for 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol?
The canonical SMILES for 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol is Nc1ccn2c(COc3ccccc3O)nnc2c1.
What is the InChIKey of 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol?
The InChIKey is ICYVDCAWKFSZTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2/c14-9-5-6-17-12(7-9)15-16-13(17)8-19-11-4-2-1-3-10(11)18/h1-7,18H,8,14H2.
What are the key properties of 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol?
2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol has a molecular weight of 256.26 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]phenol is sourced from PubChem (CID 117257264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).