7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

C9H9F3N4 — CID 43665024

IUPAC7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(NCC(F)(F)F)n2ncnc2c1
InChIInChI=1S/C9H9F3N4/c1-6-2-7(13-4-9(10,11)12)16-8(3-6)14-5-15-16/h2-3,5,13H,4H2,1H3
InChIKeyAWCDPPURKSEADM-UHFFFAOYSA-N
MW230.19 g/mol
LogP2.01
Rot. Bonds2

About 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (PubChem CID 43665024) has the molecular formula C9H9F3N4 and a molecular weight of 230.19 g/mol. Its IUPAC name is 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
PubChem CID43665024
Molecular FormulaC9H9F3N4
Molecular Weight230.19 g/mol
Exact Mass230.08
IUPAC Name7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(NCC(F)(F)F)n2ncnc2c1
InChIInChI=1S/C9H9F3N4/c1-6-2-7(13-4-9(10,11)12)16-8(3-6)14-5-15-16/h2-3,5,13H,4H2,1H3
InChIKeyAWCDPPURKSEADM-UHFFFAOYSA-N
XLogP2.01
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]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

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The IUPAC name of 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (CID 43665024) is 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The canonical SMILES for 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is Cc1cc(NCC(F)(F)F)n2ncnc2c1.
What is the InChIKey of 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The InChIKey is AWCDPPURKSEADM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N4/c1-6-2-7(13-4-9(10,11)12)16-8(3-6)14-5-15-16/h2-3,5,13H,4H2,1H3.
What are the key properties of 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine has a molecular weight of 230.19 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(2,2,2-trifluoroethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 43665024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).