1-(3-methylsulfonylcyclohexyl)propylhydrazine

C10H22N2O2S — CID 105201063

IUPAC1-(3-methylsulfonylcyclohexyl)propylhydrazine
SMILESCCC(NN)C1CCCC(S(C)(=O)=O)C1
InChIInChI=1S/C10H22N2O2S/c1-3-10(12-11)8-5-4-6-9(7-8)15(2,13)14/h8-10,12H,3-7,11H2,1-2H3
InChIKeyXWPUGNICOXVXQE-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.83
Rot. Bonds4

About 1-(3-methylsulfonylcyclohexyl)propylhydrazine

1-(3-methylsulfonylcyclohexyl)propylhydrazine (PubChem CID 105201063) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is 1-(3-methylsulfonylcyclohexyl)propylhydrazine.

Molecular Properties

Compound Name1-(3-methylsulfonylcyclohexyl)propylhydrazine
PubChem CID105201063
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC Name1-(3-methylsulfonylcyclohexyl)propylhydrazine
SMILESCCC(NN)C1CCCC(S(C)(=O)=O)C1
InChIInChI=1S/C10H22N2O2S/c1-3-10(12-11)8-5-4-6-9(7-8)15(2,13)14/h8-10,12H,3-7,11H2,1-2H3
InChIKeyXWPUGNICOXVXQE-UHFFFAOYSA-N
XLogP0.83
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.83
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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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylsulfonylcyclohexyl)propylhydrazine?
The IUPAC name of 1-(3-methylsulfonylcyclohexyl)propylhydrazine (CID 105201063) is 1-(3-methylsulfonylcyclohexyl)propylhydrazine.
What is the SMILES notation for 1-(3-methylsulfonylcyclohexyl)propylhydrazine?
The canonical SMILES for 1-(3-methylsulfonylcyclohexyl)propylhydrazine is CCC(NN)C1CCCC(S(C)(=O)=O)C1.
What is the InChIKey of 1-(3-methylsulfonylcyclohexyl)propylhydrazine?
The InChIKey is XWPUGNICOXVXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-3-10(12-11)8-5-4-6-9(7-8)15(2,13)14/h8-10,12H,3-7,11H2,1-2H3.
What are the key properties of 1-(3-methylsulfonylcyclohexyl)propylhydrazine?
1-(3-methylsulfonylcyclohexyl)propylhydrazine has a molecular weight of 234.36 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylsulfonylcyclohexyl)propylhydrazine is sourced from PubChem (CID 105201063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).