[(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine

C15H16F3N3 — CID 107505146

IUPAC[(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1cc(C(NN)c2ccccc2C(F)(F)F)cc(C)n1
InChIInChI=1S/C15H16F3N3/c1-9-7-11(8-10(2)20-9)14(21-19)12-5-3-4-6-13(12)15(16,17)18/h3-8,14,21H,19H2,1-2H3
InChIKeyLJAFUJSXIVJSSE-UHFFFAOYSA-N
MW295.31 g/mol
LogP3.27
Rot. Bonds3

About [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine

[(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 107505146) has the molecular formula C15H16F3N3 and a molecular weight of 295.31 g/mol. Its IUPAC name is [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID107505146
Molecular FormulaC15H16F3N3
Molecular Weight295.31 g/mol
Exact Mass295.13
IUPAC Name[(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESCc1cc(C(NN)c2ccccc2C(F)(F)F)cc(C)n1
InChIInChI=1S/C15H16F3N3/c1-9-7-11(8-10(2)20-9)14(21-19)12-5-3-4-6-13(12)15(16,17)18/h3-8,14,21H,19H2,1-2H3
InChIKeyLJAFUJSXIVJSSE-UHFFFAOYSA-N
XLogP3.27
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine (CID 107505146) is [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine is Cc1cc(C(NN)c2ccccc2C(F)(F)F)cc(C)n1.
What is the InChIKey of [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is LJAFUJSXIVJSSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N3/c1-9-7-11(8-10(2)20-9)14(21-19)12-5-3-4-6-13(12)15(16,17)18/h3-8,14,21H,19H2,1-2H3.
What are the key properties of [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
[(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 295.31 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,6-dimethyl-4-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 107505146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).