[4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine

C12H22N2O2S2 — CID 105310812

IUPAC[4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine
SMILESCCc1ccsc1C(CCCS(=O)(=O)CC)NN
InChIInChI=1S/C12H22N2O2S2/c1-3-10-7-8-17-12(10)11(14-13)6-5-9-18(15,16)4-2/h7-8,11,14H,3-6,9,13H2,1-2H3
InChIKeyMJZNQSDTSKSOLN-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.03
Rot. Bonds8

About [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine

[4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine (PubChem CID 105310812) has the molecular formula C12H22N2O2S2 and a molecular weight of 290.45 g/mol. Its IUPAC name is [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine
PubChem CID105310812
Molecular FormulaC12H22N2O2S2
Molecular Weight290.45 g/mol
Exact Mass290.11
IUPAC Name[4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine
SMILESCCc1ccsc1C(CCCS(=O)(=O)CC)NN
InChIInChI=1S/C12H22N2O2S2/c1-3-10-7-8-17-12(10)11(14-13)6-5-9-18(15,16)4-2/h7-8,11,14H,3-6,9,13H2,1-2H3
InChIKeyMJZNQSDTSKSOLN-UHFFFAOYSA-N
XLogP2.03
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(3-ethylthiophen-2-yl)-4-methylpent-4-enyl]hydrazine
CID 105335808
1-(3-ethylthiophen-2-yl)-N-methyl-3-methylsulfonylpropan-1-amine
CID 115848297
1-(3-ethylthiophen-2-yl)-N-methylhexan-1-amine
CID 115837220
[1-(3-ethylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105324523
4-ethylsulfonyl-1-(3-methoxythiophen-2-yl)-N-methylbutan-1-amine
CID 115865302
[1-(3-ethylthiophen-2-yl)-2-(4-iodophenyl)ethyl]hydrazine
CID 105310241
[1-(4-ethoxyphenyl)-4-ethylsulfonylbutyl]hydrazine
CID 105310823
[1-(3-ethylthiophen-2-yl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314235
1-(3-methylthiophen-2-yl)pentylhydrazine
CID 105245717
[2-(2-bromophenyl)-1-(3-ethylthiophen-2-yl)ethyl]hydrazine
CID 105283872
[2-(4-bromothiophen-2-yl)-1-(3-ethylthiophen-2-yl)ethyl]hydrazine
CID 105299228
[1-(3-ethylthiophen-2-yl)-2-(furan-3-yl)ethyl]hydrazine
CID 105331714

Frequently Asked Questions

What is the IUPAC name of [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine?
The IUPAC name of [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine (CID 105310812) is [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine.
What is the SMILES notation for [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine?
The canonical SMILES for [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine is CCc1ccsc1C(CCCS(=O)(=O)CC)NN.
What is the InChIKey of [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine?
The InChIKey is MJZNQSDTSKSOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2S2/c1-3-10-7-8-17-12(10)11(14-13)6-5-9-18(15,16)4-2/h7-8,11,14H,3-6,9,13H2,1-2H3.
What are the key properties of [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine?
[4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine has a molecular weight of 290.45 g/mol, XLogP of 2.03, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethylsulfonyl-1-(3-ethylthiophen-2-yl)butyl]hydrazine is sourced from PubChem (CID 105310812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).