[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine

C14H14F3N3O — CID 102721260

IUPAC[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
SMILESCc1ccc(C)c(Oc2cc(C(F)(F)F)cc(NN)n2)c1
InChIInChI=1S/C14H14F3N3O/c1-8-3-4-9(2)11(5-8)21-13-7-10(14(15,16)17)6-12(19-13)20-18/h3-7H,18H2,1-2H3,(H,19,20)
InChIKeyHDASRQLMJMLTJT-UHFFFAOYSA-N
MW297.28 g/mol
LogP3.80
Rot. Bonds3

About [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine

[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine (PubChem CID 102721260) has the molecular formula C14H14F3N3O and a molecular weight of 297.28 g/mol. Its IUPAC name is [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
PubChem CID102721260
Molecular FormulaC14H14F3N3O
Molecular Weight297.28 g/mol
Exact Mass297.11
IUPAC Name[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
SMILESCc1ccc(C)c(Oc2cc(C(F)(F)F)cc(NN)n2)c1
InChIInChI=1S/C14H14F3N3O/c1-8-3-4-9(2)11(5-8)21-13-7-10(14(15,16)17)6-12(19-13)20-18/h3-7H,18H2,1-2H3,(H,19,20)
InChIKeyHDASRQLMJMLTJT-UHFFFAOYSA-N
XLogP3.80
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.28
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
The IUPAC name of [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine (CID 102721260) is [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine is Cc1ccc(C)c(Oc2cc(C(F)(F)F)cc(NN)n2)c1.
What is the InChIKey of [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
The InChIKey is HDASRQLMJMLTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3O/c1-8-3-4-9(2)11(5-8)21-13-7-10(14(15,16)17)6-12(19-13)20-18/h3-7H,18H2,1-2H3,(H,19,20).
What are the key properties of [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine has a molecular weight of 297.28 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 102721260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).