1-(3-methylsulfonylcyclohexyl)butylhydrazine

C11H24N2O2S — CID 105202191

IUPAC1-(3-methylsulfonylcyclohexyl)butylhydrazine
SMILESCCCC(NN)C1CCCC(S(C)(=O)=O)C1
InChIInChI=1S/C11H24N2O2S/c1-3-5-11(13-12)9-6-4-7-10(8-9)16(2,14)15/h9-11,13H,3-8,12H2,1-2H3
InChIKeySZFBUTNIVSXWBQ-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.22
Rot. Bonds5

About 1-(3-methylsulfonylcyclohexyl)butylhydrazine

1-(3-methylsulfonylcyclohexyl)butylhydrazine (PubChem CID 105202191) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is 1-(3-methylsulfonylcyclohexyl)butylhydrazine.

Molecular Properties

Compound Name1-(3-methylsulfonylcyclohexyl)butylhydrazine
PubChem CID105202191
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC Name1-(3-methylsulfonylcyclohexyl)butylhydrazine
SMILESCCCC(NN)C1CCCC(S(C)(=O)=O)C1
InChIInChI=1S/C11H24N2O2S/c1-3-5-11(13-12)9-6-4-7-10(8-9)16(2,14)15/h9-11,13H,3-8,12H2,1-2H3
InChIKeySZFBUTNIVSXWBQ-UHFFFAOYSA-N
XLogP1.22
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.22
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-methylsulfonylcyclohexyl)butylhydrazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylsulfonylcyclohexyl)butylhydrazine?
The IUPAC name of 1-(3-methylsulfonylcyclohexyl)butylhydrazine (CID 105202191) is 1-(3-methylsulfonylcyclohexyl)butylhydrazine.
What is the SMILES notation for 1-(3-methylsulfonylcyclohexyl)butylhydrazine?
The canonical SMILES for 1-(3-methylsulfonylcyclohexyl)butylhydrazine is CCCC(NN)C1CCCC(S(C)(=O)=O)C1.
What is the InChIKey of 1-(3-methylsulfonylcyclohexyl)butylhydrazine?
The InChIKey is SZFBUTNIVSXWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-3-5-11(13-12)9-6-4-7-10(8-9)16(2,14)15/h9-11,13H,3-8,12H2,1-2H3.
What are the key properties of 1-(3-methylsulfonylcyclohexyl)butylhydrazine?
1-(3-methylsulfonylcyclohexyl)butylhydrazine has a molecular weight of 248.39 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylsulfonylcyclohexyl)butylhydrazine is sourced from PubChem (CID 105202191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).