(Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine

C11H12FN5 — CID 171390284

IUPAC(Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine
SMILESC/C(=N/N)c1nnn(-c2ccc(F)cc2)c1C
InChIInChI=1S/C11H12FN5/c1-7(14-13)11-8(2)17(16-15-11)10-5-3-9(12)4-6-10/h3-6H,13H2,1-2H3/b14-7-
InChIKeySDXGYWUGIDCORZ-AUWJEWJLSA-N
MW233.25 g/mol
LogP1.40
Rot. Bonds2

About (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine

(Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine (PubChem CID 171390284) has the molecular formula C11H12FN5 and a molecular weight of 233.25 g/mol. Its IUPAC name is (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine.

Molecular Properties

Compound Name(Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine
PubChem CID171390284
Molecular FormulaC11H12FN5
Molecular Weight233.25 g/mol
Exact Mass233.11
IUPAC Name(Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine
SMILESC/C(=N/N)c1nnn(-c2ccc(F)cc2)c1C
InChIInChI=1S/C11H12FN5/c1-7(14-13)11-8(2)17(16-15-11)10-5-3-9(12)4-6-10/h3-6H,13H2,1-2H3/b14-7-
InChIKeySDXGYWUGIDCORZ-AUWJEWJLSA-N
XLogP1.40
TPSA69.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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 (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine?
The IUPAC name of (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine (CID 171390284) is (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine.
What is the SMILES notation for (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine?
The canonical SMILES for (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine is C/C(=N/N)c1nnn(-c2ccc(F)cc2)c1C.
What is the InChIKey of (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine?
The InChIKey is SDXGYWUGIDCORZ-AUWJEWJLSA-N. The full InChI is InChI=1S/C11H12FN5/c1-7(14-13)11-8(2)17(16-15-11)10-5-3-9(12)4-6-10/h3-6H,13H2,1-2H3/b14-7-.
What are the key properties of (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine?
(Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine has a molecular weight of 233.25 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethylidenehydrazine is sourced from PubChem (CID 171390284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).