[1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine

C11H22N2O2S — CID 105290867

IUPAC[1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine
SMILESCS(=O)(=O)CCCC(NN)C1CC2CC2C1
InChIInChI=1S/C11H22N2O2S/c1-16(14,15)4-2-3-11(13-12)10-6-8-5-9(8)7-10/h8-11,13H,2-7,12H2,1H3
InChIKeyPYTBWKYNZBNBAV-UHFFFAOYSA-N
MW246.38 g/mol
LogP0.69
Rot. Bonds6

About [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine

[1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine (PubChem CID 105290867) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine
PubChem CID105290867
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC Name[1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine
SMILESCS(=O)(=O)CCCC(NN)C1CC2CC2C1
InChIInChI=1S/C11H22N2O2S/c1-16(14,15)4-2-3-11(13-12)10-6-8-5-9(8)7-10/h8-11,13H,2-7,12H2,1H3
InChIKeyPYTBWKYNZBNBAV-UHFFFAOYSA-N
XLogP0.69
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.69
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

[4-Methylsulfonyl-1-[3-(trifluoromethyl)cyclohexyl]butyl]hydrazine
CID 105290943
[1-(4,4-Difluorocyclohexyl)-4-methylsulfonylbutyl]hydrazine
CID 105290948
[4-Methylsulfonyl-1-[4-(trifluoromethyl)cyclohexyl]butyl]hydrazine
CID 105290974
[3-Methylsulfonyl-1-[3-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 114985155
[1-(4,4-Difluorocyclohexyl)-3-methylsulfonylpropyl]hydrazine
CID 114985160
[3-Methylsulfonyl-1-[4-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 114985186
(1-Cyclobutyl-5-methylsulfonylpentan-2-yl)hydrazine
CID 103170426
[2-Cyclobutyl-1-(3-methylsulfonylcyclohexyl)ethyl]hydrazine
CID 103170683
[3-Methyl-1-(3-methylsulfonylcyclohexyl)butyl]hydrazine
CID 105199009
[2-Methyl-1-(3-methylsulfonylcyclohexyl)propyl]hydrazine
CID 105199611
1-(3-Methylsulfonylcyclohexyl)propylhydrazine
CID 105201063
1-(3-Methylsulfonylcyclohexyl)ethylhydrazine
CID 105201310

Frequently Asked Questions

What is the IUPAC name of [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine?
The IUPAC name of [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine (CID 105290867) is [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine.
What is the SMILES notation for [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine?
The canonical SMILES for [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine is CS(=O)(=O)CCCC(NN)C1CC2CC2C1.
What is the InChIKey of [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine?
The InChIKey is PYTBWKYNZBNBAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-16(14,15)4-2-3-11(13-12)10-6-8-5-9(8)7-10/h8-11,13H,2-7,12H2,1H3.
What are the key properties of [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine?
[1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine has a molecular weight of 246.38 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bicyclo[3.1.0]hexanyl)-4-methylsulfonylbutyl]hydrazine is sourced from PubChem (CID 105290867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).