[2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine

C16H19FN2O — CID 105194332

IUPAC[2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine
SMILESCOc1ccc(CC(NN)c2ccc(C)cc2)cc1F
InChIInChI=1S/C16H19FN2O/c1-11-3-6-13(7-4-11)15(19-18)10-12-5-8-16(20-2)14(17)9-12/h3-9,15,19H,10,18H2,1-2H3
InChIKeyCNUKGMSUJJMNDL-UHFFFAOYSA-N
MW274.34 g/mol
LogP2.89
Rot. Bonds5

About [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine

[2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine (PubChem CID 105194332) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine
PubChem CID105194332
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC Name[2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine
SMILESCOc1ccc(CC(NN)c2ccc(C)cc2)cc1F
InChIInChI=1S/C16H19FN2O/c1-11-3-6-13(7-4-11)15(19-18)10-12-5-8-16(20-2)14(17)9-12/h3-9,15,19H,10,18H2,1-2H3
InChIKeyCNUKGMSUJJMNDL-UHFFFAOYSA-N
XLogP2.89
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 52.89
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-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine (CID 105194332) is [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine is COc1ccc(CC(NN)c2ccc(C)cc2)cc1F.
What is the InChIKey of [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine?
The InChIKey is CNUKGMSUJJMNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-11-3-6-13(7-4-11)15(19-18)10-12-5-8-16(20-2)14(17)9-12/h3-9,15,19H,10,18H2,1-2H3.
What are the key properties of [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine?
[2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine has a molecular weight of 274.34 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-fluoro-4-methoxyphenyl)-1-(4-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105194332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).