[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine

C8H9F3N2 — CID 105444009

IUPAC[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine
SMILESCc1ccc(C(F)(F)F)c(CN)n1
InChIInChI=1S/C8H9F3N2/c1-5-2-3-6(8(9,10)11)7(4-12)13-5/h2-3H,4,12H2,1H3
InChIKeyKSASRRGFSWKSAH-UHFFFAOYSA-N
MW190.17 g/mol
LogP1.87
Rot. Bonds1

About [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine

[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine (PubChem CID 105444009) has the molecular formula C8H9F3N2 and a molecular weight of 190.17 g/mol. Its IUPAC name is [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine
PubChem CID105444009
Molecular FormulaC8H9F3N2
Molecular Weight190.17 g/mol
Exact Mass190.07
IUPAC Name[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine
SMILESCc1ccc(C(F)(F)F)c(CN)n1
InChIInChI=1S/C8H9F3N2/c1-5-2-3-6(8(9,10)11)7(4-12)13-5/h2-3H,4,12H2,1H3
InChIKeyKSASRRGFSWKSAH-UHFFFAOYSA-N
XLogP1.87
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.17
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine 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 [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine?
The IUPAC name of [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine (CID 105444009) is [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine?
The canonical SMILES for [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine is Cc1ccc(C(F)(F)F)c(CN)n1.
What is the InChIKey of [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine?
The InChIKey is KSASRRGFSWKSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2/c1-5-2-3-6(8(9,10)11)7(4-12)13-5/h2-3H,4,12H2,1H3.
What are the key properties of [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine?
[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine has a molecular weight of 190.17 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine is sourced from PubChem (CID 105444009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).