7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine

C13H12FN5O — CID 126680397

IUPAC7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCC(Oc1cc(N)nc2n[nH]nc12)c1ccccc1F
InChIInChI=1S/C13H12FN5O/c1-7(8-4-2-3-5-9(8)14)20-10-6-11(15)16-13-12(10)17-19-18-13/h2-7H,1H3,(H3,15,16,17,18,19)
InChIKeyMCCQXOIFHAJMDZ-UHFFFAOYSA-N
MW273.27 g/mol
LogP2.21
Rot. Bonds3

About 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine

7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 126680397) has the molecular formula C13H12FN5O and a molecular weight of 273.27 g/mol. Its IUPAC name is 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID126680397
Molecular FormulaC13H12FN5O
Molecular Weight273.27 g/mol
Exact Mass273.10
IUPAC Name7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCC(Oc1cc(N)nc2n[nH]nc12)c1ccccc1F
InChIInChI=1S/C13H12FN5O/c1-7(8-4-2-3-5-9(8)14)20-10-6-11(15)16-13-12(10)17-19-18-13/h2-7H,1H3,(H3,15,16,17,18,19)
InChIKeyMCCQXOIFHAJMDZ-UHFFFAOYSA-N
XLogP2.21
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.27
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-[1-(2-fluorophenyl)-2-phenylethyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 130431877
7-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648804
7-[1-(2-methylsulfonylphenyl)ethylsulfanyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 130365263
7-[1-phenyl-5-[2-(trifluoromethoxy)phenyl]pentyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 158757852
7-[[3-(4-phenylphenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649018
7-(cyclodecapentaenylmethyl)-2H-triazolo[4,5-b]pyridin-5-amine
CID 126676489
7-[[3-(5-fluoro-3-pyridinyl)-2-methylphenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649157
7-[[4-(5-fluoro-3-pyridinyl)-2-(trifluoromethoxy)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126678914
2-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-6-methylpyrimidin-4-amine
CID 80656756
7-[(2,6-dimethylcyclohexyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649151
7-[2-(2-chlorophenyl)-1-phenylethyl]-2H-triazolo[4,5-b]pyridin-5-amine;ethane;7-[1-(3-fluorophenyl)ethyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 145371916
7-[[3-(4-methylimidazol-1-yl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649084

Frequently Asked Questions

What is the IUPAC name of 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine (CID 126680397) is 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine is CC(Oc1cc(N)nc2n[nH]nc12)c1ccccc1F.
What is the InChIKey of 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is MCCQXOIFHAJMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN5O/c1-7(8-4-2-3-5-9(8)14)20-10-6-11(15)16-13-12(10)17-19-18-13/h2-7H,1H3,(H3,15,16,17,18,19).
What are the key properties of 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 273.27 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(2-fluorophenyl)ethoxy]-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 126680397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).