[1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine

C17H21FN2S — CID 106884341

IUPAC[1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine
SMILESCc1ccc(SCC(NN)c2c(C)cc(C)cc2F)cc1
InChIInChI=1S/C17H21FN2S/c1-11-4-6-14(7-5-11)21-10-16(20-19)17-13(3)8-12(2)9-15(17)18/h4-9,16,20H,10,19H2,1-3H3
InChIKeyZFQXHVJNXFUHDO-UHFFFAOYSA-N
MW304.43 g/mol
LogP4.05
Rot. Bonds5

About [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine

[1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine (PubChem CID 106884341) has the molecular formula C17H21FN2S and a molecular weight of 304.43 g/mol. Its IUPAC name is [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine
PubChem CID106884341
Molecular FormulaC17H21FN2S
Molecular Weight304.43 g/mol
Exact Mass304.14
IUPAC Name[1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine
SMILESCc1ccc(SCC(NN)c2c(C)cc(C)cc2F)cc1
InChIInChI=1S/C17H21FN2S/c1-11-4-6-14(7-5-11)21-10-16(20-19)17-13(3)8-12(2)9-15(17)18/h4-9,16,20H,10,19H2,1-3H3
InChIKeyZFQXHVJNXFUHDO-UHFFFAOYSA-N
XLogP4.05
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 54.05
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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Related Compounds

2-(4-chlorophenyl)sulfanyl-1-(2-fluoro-4,6-dimethylphenyl)-N-methylethanamine
CID 106881691
1-(2-fluoro-4,6-dimethylphenyl)-N-methyl-2-phenylsulfanylethanamine
CID 106881610
[1-(2,4-difluorophenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine
CID 105236949
2-(4-chlorophenyl)sulfanyl-1-(2-fluoro-4,6-dimethylphenyl)ethanol
CID 106881089
2-(4-bromophenyl)sulfanyl-1-(2-fluoro-4,6-dimethylphenyl)ethanol
CID 106881082
3-[1-hydrazinyl-2-(4-methylphenyl)sulfanylethyl]-4-methylpyridin-2-amine
CID 105237021
[1-(2-fluoro-4,6-dimethylphenyl)-3-phenylpropyl]hydrazine
CID 106884252
[1-(2,6-difluoro-3-methylphenyl)-2-(3-methylphenyl)sulfanylethyl]hydrazine
CID 105237121
1-(2-fluoro-4,6-dimethylphenyl)heptylhydrazine
CID 106884598
[1-(2-fluoro-4,6-dimethylphenyl)-3-(2-methylphenyl)propyl]hydrazine
CID 106884529
[1-(2-fluoro-4,6-dimethylphenyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 106884466
[1-(2,4-dimethylphenyl)-2-(3-fluorophenyl)sulfanylethyl]hydrazine
CID 105236399

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine?
The IUPAC name of [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine (CID 106884341) is [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine is Cc1ccc(SCC(NN)c2c(C)cc(C)cc2F)cc1.
What is the InChIKey of [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine?
The InChIKey is ZFQXHVJNXFUHDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2S/c1-11-4-6-14(7-5-11)21-10-16(20-19)17-13(3)8-12(2)9-15(17)18/h4-9,16,20H,10,19H2,1-3H3.
What are the key properties of [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine?
[1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine has a molecular weight of 304.43 g/mol, XLogP of 4.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methylphenyl)sulfanylethyl]hydrazine is sourced from PubChem (CID 106884341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).