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

C11H17FN2OS — CID 103397758

IUPAC[1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine
SMILESCOc1ccc(C(CCSC)NN)c(F)c1
InChIInChI=1S/C11H17FN2OS/c1-15-8-3-4-9(10(12)7-8)11(14-13)5-6-16-2/h3-4,7,11,14H,5-6,13H2,1-2H3
InChIKeyHBXUSIJRWOESDV-UHFFFAOYSA-N
MW244.33 g/mol
LogP2.09
Rot. Bonds6

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

[1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine (PubChem CID 103397758) has the molecular formula C11H17FN2OS and a molecular weight of 244.33 g/mol. Its IUPAC name is [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine
PubChem CID103397758
Molecular FormulaC11H17FN2OS
Molecular Weight244.33 g/mol
Exact Mass244.10
IUPAC Name[1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine
SMILESCOc1ccc(C(CCSC)NN)c(F)c1
InChIInChI=1S/C11H17FN2OS/c1-15-8-3-4-9(10(12)7-8)11(14-13)5-6-16-2/h3-4,7,11,14H,5-6,13H2,1-2H3
InChIKeyHBXUSIJRWOESDV-UHFFFAOYSA-N
XLogP2.09
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 52.09
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-(2-fluoro-4-methoxyphenyl)-3-methoxypropyl]hydrazine
CID 103397541
1-(2-fluoro-4-methoxyphenyl)heptylhydrazine
CID 105256947
[1-(2-fluoro-4-methoxyphenyl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 103397694
[5,5,5-trifluoro-1-(2-fluoro-4-methoxyphenyl)pentyl]hydrazine
CID 105256874
[1-(4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine
CID 105286240
1-(2-fluoro-4-methoxyphenyl)but-3-enylhydrazine
CID 105256934
[2-ethoxy-1-(2-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105256872
[1-(2-fluoro-4-methoxyphenyl)-3-methylhexyl]hydrazine
CID 105256894
[1-(2-fluoro-4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]hydrazine
CID 103397813
[1-(2-fluoro-4-methoxyphenyl)-2-propoxyethyl]hydrazine
CID 105256812
[1-(2-fluoro-4-methoxyphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105256870
[1-(4-fluoro-2-methylphenyl)-3-methylsulfanylpropyl]hydrazine
CID 105302462

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine?
The IUPAC name of [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine (CID 103397758) is [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine is COc1ccc(C(CCSC)NN)c(F)c1.
What is the InChIKey of [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine?
The InChIKey is HBXUSIJRWOESDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2OS/c1-15-8-3-4-9(10(12)7-8)11(14-13)5-6-16-2/h3-4,7,11,14H,5-6,13H2,1-2H3.
What are the key properties of [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine?
[1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine has a molecular weight of 244.33 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-4-methoxyphenyl)-3-methylsulfanylpropyl]hydrazine is sourced from PubChem (CID 103397758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).