[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine

C11H12FN3S — CID 105254568

IUPAC[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)c2cscn2)c1
InChIInChI=1S/C11H12FN3S/c1-7-2-8(4-9(12)3-7)11(15-13)10-5-16-6-14-10/h2-6,11,15H,13H2,1H3
InChIKeyVFXSYCLUPUFDRI-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.14
Rot. Bonds3

About [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine

[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine (PubChem CID 105254568) has the molecular formula C11H12FN3S and a molecular weight of 237.30 g/mol. Its IUPAC name is [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine
PubChem CID105254568
Molecular FormulaC11H12FN3S
Molecular Weight237.30 g/mol
Exact Mass237.07
IUPAC Name[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)c2cscn2)c1
InChIInChI=1S/C11H12FN3S/c1-7-2-8(4-9(12)3-7)11(15-13)10-5-16-6-14-10/h2-6,11,15H,13H2,1H3
InChIKeyVFXSYCLUPUFDRI-UHFFFAOYSA-N
XLogP2.14
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.14
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 [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
The IUPAC name of [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine (CID 105254568) is [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine is Cc1cc(F)cc(C(NN)c2cscn2)c1.
What is the InChIKey of [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
The InChIKey is VFXSYCLUPUFDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3S/c1-7-2-8(4-9(12)3-7)11(15-13)10-5-16-6-14-10/h2-6,11,15H,13H2,1H3.
What are the key properties of [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine?
[(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine has a molecular weight of 237.30 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-5-methylphenyl)-(1,3-thiazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105254568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).