[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine

C13H15FN2O — CID 105269294

IUPAC[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine
SMILESCc1cc(C(NN)c2occc2C)ccc1F
InChIInChI=1S/C13H15FN2O/c1-8-5-6-17-13(8)12(16-15)10-3-4-11(14)9(2)7-10/h3-7,12,16H,15H2,1-2H3
InChIKeyZJFABFZTHWTOTF-UHFFFAOYSA-N
MW234.27 g/mol
LogP2.59
Rot. Bonds3

About [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine

[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine (PubChem CID 105269294) has the molecular formula C13H15FN2O and a molecular weight of 234.27 g/mol. Its IUPAC name is [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine
PubChem CID105269294
Molecular FormulaC13H15FN2O
Molecular Weight234.27 g/mol
Exact Mass234.12
IUPAC Name[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine
SMILESCc1cc(C(NN)c2occc2C)ccc1F
InChIInChI=1S/C13H15FN2O/c1-8-5-6-17-13(8)12(16-15)10-3-4-11(14)9(2)7-10/h3-7,12,16H,15H2,1-2H3
InChIKeyZJFABFZTHWTOTF-UHFFFAOYSA-N
XLogP2.59
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.27
LogP ≤ 52.59
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-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
The IUPAC name of [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine (CID 105269294) is [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine is Cc1cc(C(NN)c2occc2C)ccc1F.
What is the InChIKey of [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
The InChIKey is ZJFABFZTHWTOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2O/c1-8-5-6-17-13(8)12(16-15)10-3-4-11(14)9(2)7-10/h3-7,12,16H,15H2,1-2H3.
What are the key properties of [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine has a molecular weight of 234.27 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105269294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).