[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine

C16H15FN2O2 — CID 105262495

IUPAC[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(F)cc1C(NN)c1coc2ccccc12
InChIInChI=1S/C16H15FN2O2/c1-20-14-7-6-10(17)8-12(14)16(19-18)13-9-21-15-5-3-2-4-11(13)15/h2-9,16,19H,18H2,1H3
InChIKeyMMPKRJKUYZQVTR-UHFFFAOYSA-N
MW286.31 g/mol
LogP3.13
Rot. Bonds4

About [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine

[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine (PubChem CID 105262495) has the molecular formula C16H15FN2O2 and a molecular weight of 286.31 g/mol. Its IUPAC name is [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
PubChem CID105262495
Molecular FormulaC16H15FN2O2
Molecular Weight286.31 g/mol
Exact Mass286.11
IUPAC Name[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(F)cc1C(NN)c1coc2ccccc12
InChIInChI=1S/C16H15FN2O2/c1-20-14-7-6-10(17)8-12(14)16(19-18)13-9-21-15-5-3-2-4-11(13)15/h2-9,16,19H,18H2,1H3
InChIKeyMMPKRJKUYZQVTR-UHFFFAOYSA-N
XLogP3.13
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 53.13
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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Related Compounds

[1-benzofuran-3-yl-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105262431
bis(2-methoxyphenyl)methylhydrazine
CID 105191029
[(3,5-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105330877
[(5-fluoro-2-methoxyphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194406
[(4-bromo-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105280978
[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine
CID 105262493
[(4-bromophenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105192470
[(2-chloro-4-methylphenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 106860165
[(2-bromo-5-fluorophenyl)-(2-methoxy-5-methylphenyl)methyl]hydrazine
CID 105303569
[1-benzofuran-3-yl-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105262569
[(3-bromo-4-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105330905
[(5-fluoro-2-methoxyphenyl)-(6-methyl-2-pyridinyl)methyl]hydrazine
CID 105219168

Frequently Asked Questions

What is the IUPAC name of [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine (CID 105262495) is [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine is COc1ccc(F)cc1C(NN)c1coc2ccccc12.
What is the InChIKey of [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
The InChIKey is MMPKRJKUYZQVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O2/c1-20-14-7-6-10(17)8-12(14)16(19-18)13-9-21-15-5-3-2-4-11(13)15/h2-9,16,19H,18H2,1H3.
What are the key properties of [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine has a molecular weight of 286.31 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105262495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).