[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine

C12H20N2OS — CID 105225226

IUPAC[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine
SMILESCCOc1cccc(C(CSCC)NN)c1
InChIInChI=1S/C12H20N2OS/c1-3-15-11-7-5-6-10(8-11)12(14-13)9-16-4-2/h5-8,12,14H,3-4,9,13H2,1-2H3
InChIKeyDOVMKKPMJYQQJG-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.34
Rot. Bonds7

About [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine

[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine (PubChem CID 105225226) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine
PubChem CID105225226
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine
SMILESCCOc1cccc(C(CSCC)NN)c1
InChIInChI=1S/C12H20N2OS/c1-3-15-11-7-5-6-10(8-11)12(14-13)9-16-4-2/h5-8,12,14H,3-4,9,13H2,1-2H3
InChIKeyDOVMKKPMJYQQJG-UHFFFAOYSA-N
XLogP2.34
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.34
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

[2-ethylsulfanyl-1-(3-propan-2-yloxyphenyl)ethyl]hydrazine
CID 105225417
[1-(3-ethoxyphenyl)-2-propan-2-ylsulfanylethyl]hydrazine
CID 105225968
[2-(3-chlorophenyl)sulfanyl-1-(3-ethoxyphenyl)ethyl]hydrazine
CID 105237806
[2-(4-bromophenyl)sulfanyl-1-(3-ethoxyphenyl)ethyl]hydrazine
CID 105235869
[1-(3-ethoxyphenyl)-3-methylbut-3-enyl]hydrazine
CID 105192051
[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine
CID 105191999
[1-(3-ethoxyphenyl)-3-phenoxypropyl]hydrazine
CID 105191343
[1-(3-ethoxyphenyl)-2-methylsulfonylethyl]hydrazine
CID 105328109
[1-(3-ethoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105192057
[2-(4-bromophenyl)-1-(3-ethoxyphenyl)ethyl]hydrazine
CID 105192046
[1-(3-ethoxyphenyl)-2-(4-iodophenyl)ethyl]hydrazine
CID 105191961
(2-ethylsulfanyl-1-pyridin-3-ylethyl)hydrazine
CID 105225478

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine?
The IUPAC name of [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine (CID 105225226) is [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine is CCOc1cccc(C(CSCC)NN)c1.
What is the InChIKey of [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine?
The InChIKey is DOVMKKPMJYQQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-3-15-11-7-5-6-10(8-11)12(14-13)9-16-4-2/h5-8,12,14H,3-4,9,13H2,1-2H3.
What are the key properties of [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine?
[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine has a molecular weight of 240.37 g/mol, XLogP of 2.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine is sourced from PubChem (CID 105225226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).