8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine

C14H11F3N4 — CID 82059022

IUPAC8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
SMILESCc1cc(N)cn2c(-c3ccc(C(F)(F)F)cc3)nnc12
InChIInChI=1S/C14H11F3N4/c1-8-6-11(18)7-21-12(8)19-20-13(21)9-2-4-10(5-3-9)14(15,16)17/h2-7H,18H2,1H3
InChIKeyQNAPGDKTJHHKND-UHFFFAOYSA-N
MW292.26 g/mol
LogP3.31
Rot. Bonds1

About 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine

8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine (PubChem CID 82059022) has the molecular formula C14H11F3N4 and a molecular weight of 292.26 g/mol. Its IUPAC name is 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine.

Molecular Properties

Compound Name8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
PubChem CID82059022
Molecular FormulaC14H11F3N4
Molecular Weight292.26 g/mol
Exact Mass292.09
IUPAC Name8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine
SMILESCc1cc(N)cn2c(-c3ccc(C(F)(F)F)cc3)nnc12
InChIInChI=1S/C14H11F3N4/c1-8-6-11(18)7-21-12(8)19-20-13(21)9-2-4-10(5-3-9)14(15,16)17/h2-7H,18H2,1H3
InChIKeyQNAPGDKTJHHKND-UHFFFAOYSA-N
XLogP3.31
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.26
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-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

6-bromo-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 39080197
3-(4-fluorophenyl)-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 83966007
8-methyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-6-amine
CID 115910845
7-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 3696703
6-fluoro-3-(4-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 83965957
3-[(4-fluorophenyl)methyl]-8-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82058990
6-chloro-3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 39080056
2-methyl-4-[4-(trifluoromethyl)phenyl]aniline
CID 23005194
6-bromo-3-(3,4-dimethylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-8-amine
CID 39080153
7-chloro-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-c]pyrimidine
CID 43327083
2-methoxy-5-[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]aniline
CID 93206142
8-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyridin-6-amine
CID 112555669

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The IUPAC name of 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine (CID 82059022) is 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine.
What is the SMILES notation for 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The canonical SMILES for 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine is Cc1cc(N)cn2c(-c3ccc(C(F)(F)F)cc3)nnc12.
What is the InChIKey of 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The InChIKey is QNAPGDKTJHHKND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N4/c1-8-6-11(18)7-21-12(8)19-20-13(21)9-2-4-10(5-3-9)14(15,16)17/h2-7H,18H2,1H3.
What are the key properties of 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine has a molecular weight of 292.26 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-amine is sourced from PubChem (CID 82059022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).