[1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine

C11H18N2O2S — CID 105326383

IUPAC[1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine
SMILESCCc1cccc(C(CS(C)(=O)=O)NN)c1
InChIInChI=1S/C11H18N2O2S/c1-3-9-5-4-6-10(7-9)11(13-12)8-16(2,14)15/h4-7,11,13H,3,8,12H2,1-2H3
InChIKeyQDDNAPOKYPYTDR-UHFFFAOYSA-N
MW242.34 g/mol
LogP0.80
Rot. Bonds5

About [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine

[1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine (PubChem CID 105326383) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine
PubChem CID105326383
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC Name[1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine
SMILESCCc1cccc(C(CS(C)(=O)=O)NN)c1
InChIInChI=1S/C11H18N2O2S/c1-3-9-5-4-6-10(7-9)11(13-12)8-16(2,14)15/h4-7,11,13H,3,8,12H2,1-2H3
InChIKeyQDDNAPOKYPYTDR-UHFFFAOYSA-N
XLogP0.80
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 50.80
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'}

Analyze [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(3-ethoxyphenyl)-2-methylsulfonylethyl]hydrazine
CID 105328109
[2-cyclopropyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105253991
[4-chloro-1-(3-ethylphenyl)butyl]hydrazine
CID 105235498
[1-(3-ethylphenyl)-2-propylsulfanylethyl]hydrazine
CID 105225597
[1-(3-ethylphenyl)-4-methoxypentyl]hydrazine
CID 105326321
[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine
CID 105326402
(2-methylsulfonyl-1-quinolin-6-ylethyl)hydrazine
CID 105327359
[1-(3-methylsulfonylphenyl)-2-phenylethyl]hydrazine
CID 105283041
[2-cyclohexylsulfanyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105227705
[2-(3-chloro-2-fluorophenyl)-1-(3-ethylphenyl)ethyl]hydrazine
CID 105264293
[1-(3-ethylphenyl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 105214571
1-(4-ethylphenyl)-N-methyl-2-methylsulfonylethanamine
CID 62543737

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine?
The IUPAC name of [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine (CID 105326383) is [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine.
What is the SMILES notation for [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine?
The canonical SMILES for [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine is CCc1cccc(C(CS(C)(=O)=O)NN)c1.
What is the InChIKey of [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine?
The InChIKey is QDDNAPOKYPYTDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-3-9-5-4-6-10(7-9)11(13-12)8-16(2,14)15/h4-7,11,13H,3,8,12H2,1-2H3.
What are the key properties of [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine?
[1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine has a molecular weight of 242.34 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethylphenyl)-2-methylsulfonylethyl]hydrazine is sourced from PubChem (CID 105326383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).