6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

C13H11FN4 — CID 83965114

IUPAC6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCc1cccc(-c2nc3c(N)cc(F)cn3n2)c1
InChIInChI=1S/C13H11FN4/c1-8-3-2-4-9(5-8)12-16-13-11(15)6-10(14)7-18(13)17-12/h2-7H,15H2,1H3
InChIKeyKZWSVPJUIODYPE-UHFFFAOYSA-N
MW242.26 g/mol
LogP2.43
Rot. Bonds1

About 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (PubChem CID 83965114) has the molecular formula C13H11FN4 and a molecular weight of 242.26 g/mol. Its IUPAC name is 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
PubChem CID83965114
Molecular FormulaC13H11FN4
Molecular Weight242.26 g/mol
Exact Mass242.10
IUPAC Name6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCc1cccc(-c2nc3c(N)cc(F)cn3n2)c1
InChIInChI=1S/C13H11FN4/c1-8-3-2-4-9(5-8)12-16-13-11(15)6-10(14)7-18(13)17-12/h2-7H,15H2,1H3
InChIKeyKZWSVPJUIODYPE-UHFFFAOYSA-N
XLogP2.43
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.26
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 83964997
6-fluoro-2-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 83965118
4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
CID 63866847
2-(3-methylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine
CID 171058363
(1S)-1-[6-(3-methylphenyl)-[1,2,4]triazolo[3,4-f][1,2,4]triazin-8-yl]ethanamine
CID 82381197
5-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117133001
6-fluoro-2-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 83965109
5-(8-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylaniline
CID 83967080
2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 82389030
6-chloro-2-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
CID 83965049
3-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)aniline
CID 82566376
7-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 83965839

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The IUPAC name of 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (CID 83965114) is 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The canonical SMILES for 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is Cc1cccc(-c2nc3c(N)cc(F)cn3n2)c1.
What is the InChIKey of 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The InChIKey is KZWSVPJUIODYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4/c1-8-3-2-4-9(5-8)12-16-13-11(15)6-10(14)7-18(13)17-12/h2-7H,15H2,1H3.
What are the key properties of 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine has a molecular weight of 242.26 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 83965114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).