[(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine

C12H13FN2S — CID 102842613

IUPAC[(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCc1sccc1C(NN)c1ccc(F)cc1
InChIInChI=1S/C12H13FN2S/c1-8-11(6-7-16-8)12(15-14)9-2-4-10(13)5-3-9/h2-7,12,15H,14H2,1H3
InChIKeyGQSJPSFJVLYDJL-UHFFFAOYSA-N
MW236.32 g/mol
LogP2.75
Rot. Bonds3

About [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine

[(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine (PubChem CID 102842613) has the molecular formula C12H13FN2S and a molecular weight of 236.32 g/mol. Its IUPAC name is [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
PubChem CID102842613
Molecular FormulaC12H13FN2S
Molecular Weight236.32 g/mol
Exact Mass236.08
IUPAC Name[(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCc1sccc1C(NN)c1ccc(F)cc1
InChIInChI=1S/C12H13FN2S/c1-8-11(6-7-16-8)12(15-14)9-2-4-10(13)5-3-9/h2-7,12,15H,14H2,1H3
InChIKeyGQSJPSFJVLYDJL-UHFFFAOYSA-N
XLogP2.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 52.75
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 [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The IUPAC name of [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine (CID 102842613) is [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine is Cc1sccc1C(NN)c1ccc(F)cc1.
What is the InChIKey of [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The InChIKey is GQSJPSFJVLYDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2S/c1-8-11(6-7-16-8)12(15-14)9-2-4-10(13)5-3-9/h2-7,12,15H,14H2,1H3.
What are the key properties of [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
[(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine has a molecular weight of 236.32 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-fluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 102842613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).