[(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine

C14H12F4N2O — CID 105329259

IUPAC[(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2ccc(F)c(F)c2F)c1F
InChIInChI=1S/C14H12F4N2O/c1-21-10-4-2-3-7(11(10)16)14(20-19)8-5-6-9(15)13(18)12(8)17/h2-6,14,20H,19H2,1H3
InChIKeyWYEXLORGYFXLJT-UHFFFAOYSA-N
MW300.26 g/mol
LogP2.80
Rot. Bonds4

About [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine

[(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine (PubChem CID 105329259) has the molecular formula C14H12F4N2O and a molecular weight of 300.26 g/mol. Its IUPAC name is [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
PubChem CID105329259
Molecular FormulaC14H12F4N2O
Molecular Weight300.26 g/mol
Exact Mass300.09
IUPAC Name[(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2ccc(F)c(F)c2F)c1F
InChIInChI=1S/C14H12F4N2O/c1-21-10-4-2-3-7(11(10)16)14(20-19)8-5-6-9(15)13(18)12(8)17/h2-6,14,20H,19H2,1H3
InChIKeyWYEXLORGYFXLJT-UHFFFAOYSA-N
XLogP2.80
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.26
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2-chloro-6-fluorophenyl)-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105329251
1-(2-methoxyphenyl)-N-methyl-1-(2,3,4-trifluorophenyl)methanamine
CID 62963769
[(2-bromo-4-methylphenyl)-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105329304
[(5-bromofuran-2-yl)-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105329407
[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine
CID 105261827
[1-benzofuran-3-yl-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105262431
[(2-methylsulfanylphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105305698
[(4-chloro-2-fluorophenyl)-(2,3-dimethoxyphenyl)methyl]hydrazine
CID 105328431
bis(2-methoxyphenyl)methylhydrazine
CID 105191029
[(2,3-dimethoxyphenyl)-(2-fluorophenyl)methyl]hydrazine
CID 105292401
(2,3-dimethoxyphenyl)-(2,3,4-trifluorophenyl)methanamine
CID 82106214
1-(4-chloro-2-fluorophenyl)-1-(2-fluoro-3-methoxyphenyl)-N-methylmethanamine
CID 82807492

Frequently Asked Questions

What is the IUPAC name of [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
The IUPAC name of [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine (CID 105329259) is [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
The canonical SMILES for [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine is COc1cccc(C(NN)c2ccc(F)c(F)c2F)c1F.
What is the InChIKey of [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
The InChIKey is WYEXLORGYFXLJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F4N2O/c1-21-10-4-2-3-7(11(10)16)14(20-19)8-5-6-9(15)13(18)12(8)17/h2-6,14,20H,19H2,1H3.
What are the key properties of [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
[(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine has a molecular weight of 300.26 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-fluoro-3-methoxyphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105329259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).