7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine

C11H8FN5O — CID 118950300

IUPAC7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine
SMILESFc1cccnc1COc1ccnc2n[nH]nc12
InChIInChI=1S/C11H8FN5O/c12-7-2-1-4-13-8(7)6-18-9-3-5-14-11-10(9)15-17-16-11/h1-5H,6H2,(H,14,15,16,17)
InChIKeyYFKBCNRIXHSWKT-UHFFFAOYSA-N
MW245.22 g/mol
LogP1.47
Rot. Bonds3

About 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine

7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine (PubChem CID 118950300) has the molecular formula C11H8FN5O and a molecular weight of 245.22 g/mol. Its IUPAC name is 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine.

Molecular Properties

Compound Name7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine
PubChem CID118950300
Molecular FormulaC11H8FN5O
Molecular Weight245.22 g/mol
Exact Mass245.07
IUPAC Name7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine
SMILESFc1cccnc1COc1ccnc2n[nH]nc12
InChIInChI=1S/C11H8FN5O/c12-7-2-1-4-13-8(7)6-18-9-3-5-14-11-10(9)15-17-16-11/h1-5H,6H2,(H,14,15,16,17)
InChIKeyYFKBCNRIXHSWKT-UHFFFAOYSA-N
XLogP1.47
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.22
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-phenylmethoxy-2H-triazolo[4,5-b]pyridin-5-amine
CID 6415548
7-(2-methoxyethoxy)-2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridine
CID 10215218
7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949632
7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118950056
7-[[5-(difluoromethyl)-2-phenyltriazol-4-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118950274
7-((2-Fluorobenzyl)oxy)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
CID 126648996
7-[(2-pyrazol-1-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649120
1H-Purin-2-amine, 6-(2-pyridinylmethoxy)-
CID 5329538
3-[3-(Difluoromethoxy)-2-pyridinyl]-1-methyl-6-(pyridin-2-ylmethoxy)pyrazolo[3,4-b]pyrazine
CID 76336233
3H-1,2,3-Triazolo[4,5-b]pyridine, 3-(3-methoxyphenyl)-
CID 9991272
3-(2-Methoxyphenyl)-3H-[1,2,3]triazolo[4,5-b]pyridine
CID 12445492
US10172856, Example 104
CID 137394991

Frequently Asked Questions

What is the IUPAC name of 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine?
The IUPAC name of 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine (CID 118950300) is 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine.
What is the SMILES notation for 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine?
The canonical SMILES for 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine is Fc1cccnc1COc1ccnc2n[nH]nc12.
What is the InChIKey of 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine?
The InChIKey is YFKBCNRIXHSWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN5O/c12-7-2-1-4-13-8(7)6-18-9-3-5-14-11-10(9)15-17-16-11/h1-5H,6H2,(H,14,15,16,17).
What are the key properties of 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine?
7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine has a molecular weight of 245.22 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3-fluoro-2-pyridinyl)methoxy]-2H-triazolo[4,5-b]pyridine is sourced from PubChem (CID 118950300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).