[(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine

C12H12F2N2O — CID 105303231

IUPAC[(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2ccc(F)cc2F)o1
InChIInChI=1S/C12H12F2N2O/c1-7-2-5-11(17-7)12(16-15)9-4-3-8(13)6-10(9)14/h2-6,12,16H,15H2,1H3
InChIKeyUFHNKQXBOMMTBT-UHFFFAOYSA-N
MW238.24 g/mol
LogP2.42
Rot. Bonds3

About [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine

[(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine (PubChem CID 105303231) has the molecular formula C12H12F2N2O and a molecular weight of 238.24 g/mol. Its IUPAC name is [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine
PubChem CID105303231
Molecular FormulaC12H12F2N2O
Molecular Weight238.24 g/mol
Exact Mass238.09
IUPAC Name[(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2ccc(F)cc2F)o1
InChIInChI=1S/C12H12F2N2O/c1-7-2-5-11(17-7)12(16-15)9-4-3-8(13)6-10(9)14/h2-6,12,16H,15H2,1H3
InChIKeyUFHNKQXBOMMTBT-UHFFFAOYSA-N
XLogP2.42
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 52.42
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 [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine?
The IUPAC name of [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine (CID 105303231) is [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine is Cc1ccc(C(NN)c2ccc(F)cc2F)o1.
What is the InChIKey of [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine?
The InChIKey is UFHNKQXBOMMTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2O/c1-7-2-5-11(17-7)12(16-15)9-4-3-8(13)6-10(9)14/h2-6,12,16H,15H2,1H3.
What are the key properties of [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine?
[(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine has a molecular weight of 238.24 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-difluorophenyl)-(5-methylfuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105303231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).