3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine

C13H10FN3 — CID 117139789

IUPAC3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccc2nnc(-c3cccc(F)c3)n2c1
InChIInChI=1S/C13H10FN3/c1-9-5-6-12-15-16-13(17(12)8-9)10-3-2-4-11(14)7-10/h2-8H,1H3
InChIKeyCMQMMIDLIARWAE-UHFFFAOYSA-N
MW227.24 g/mol
LogP2.84
Rot. Bonds1

About 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine

3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 117139789) has the molecular formula C13H10FN3 and a molecular weight of 227.24 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID117139789
Molecular FormulaC13H10FN3
Molecular Weight227.24 g/mol
Exact Mass227.09
IUPAC Name3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccc2nnc(-c3cccc(F)c3)n2c1
InChIInChI=1S/C13H10FN3/c1-9-5-6-12-15-16-13(17(12)8-9)10-3-2-4-11(14)7-10/h2-8H,1H3
InChIKeyCMQMMIDLIARWAE-UHFFFAOYSA-N
XLogP2.84
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine-8-carbaldehyde
CID 83966105
3-bromo-6-(3-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 67083662
6-methyl-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117139828
6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine
CID 590435
1-fluoro-3-(3-fluorophenyl)-5-methylbenzene
CID 46313952
6-chloro-3-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117139760
6-methyl-3-[(3-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117139519
6-fluoro-3-(3-fluorophenyl)-2-methylimidazo[1,2-a]pyridine
CID 114835263
6-methyl-3-pyridin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 117139491
3-(3,5-dimethylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 55087007
5-(3-fluorophenyl)-N,4-dimethyl-1,2,4-triazol-3-amine
CID 83882734
methyl 3-[6-(2,4-difluorophenyl)sulfanyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl]benzoate
CID 11538523

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine (CID 117139789) is 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine is Cc1ccc2nnc(-c3cccc(F)c3)n2c1.
What is the InChIKey of 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is CMQMMIDLIARWAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3/c1-9-5-6-12-15-16-13(17(12)8-9)10-3-2-4-11(14)7-10/h2-8H,1H3.
What are the key properties of 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine?
3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 227.24 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 117139789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).