[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine

C13H10F5N3 — CID 105335389

IUPAC[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1ccc(F)c(C(F)(F)F)c1)c1ccncc1F
InChIInChI=1S/C13H10F5N3/c14-10-2-1-7(5-9(10)13(16,17)18)12(21-19)8-3-4-20-6-11(8)15/h1-6,12,21H,19H2
InChIKeyUXHJZWDZDXUOEA-UHFFFAOYSA-N
MW303.23 g/mol
LogP2.93
Rot. Bonds3

About [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine

[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105335389) has the molecular formula C13H10F5N3 and a molecular weight of 303.23 g/mol. Its IUPAC name is [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105335389
Molecular FormulaC13H10F5N3
Molecular Weight303.23 g/mol
Exact Mass303.08
IUPAC Name[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1ccc(F)c(C(F)(F)F)c1)c1ccncc1F
InChIInChI=1S/C13H10F5N3/c14-10-2-1-7(5-9(10)13(16,17)18)12(21-19)8-3-4-20-6-11(8)15/h1-6,12,21H,19H2
InChIKeyUXHJZWDZDXUOEA-UHFFFAOYSA-N
XLogP2.93
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.23
LogP ≤ 52.93
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 [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105335389) is [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine is NNC(c1ccc(F)c(C(F)(F)F)c1)c1ccncc1F.
What is the InChIKey of [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is UXHJZWDZDXUOEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F5N3/c14-10-2-1-7(5-9(10)13(16,17)18)12(21-19)8-3-4-20-6-11(8)15/h1-6,12,21H,19H2.
What are the key properties of [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 303.23 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105335389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).