[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine

C11H22N2S — CID 106648982

IUPAC[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine
SMILESCC(C)SCC(NN)C1=CCCCC1
InChIInChI=1S/C11H22N2S/c1-9(2)14-8-11(13-12)10-6-4-3-5-7-10/h6,9,11,13H,3-5,7-8,12H2,1-2H3
InChIKeyPRDVBRWFKZFTSX-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.46
Rot. Bonds5

About [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine

[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine (PubChem CID 106648982) has the molecular formula C11H22N2S and a molecular weight of 214.38 g/mol. Its IUPAC name is [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine
PubChem CID106648982
Molecular FormulaC11H22N2S
Molecular Weight214.38 g/mol
Exact Mass214.15
IUPAC Name[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine
SMILESCC(C)SCC(NN)C1=CCCCC1
InChIInChI=1S/C11H22N2S/c1-9(2)14-8-11(13-12)10-6-4-3-5-7-10/h6,9,11,13H,3-5,7-8,12H2,1-2H3
InChIKeyPRDVBRWFKZFTSX-UHFFFAOYSA-N
XLogP2.46
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine?
The IUPAC name of [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine (CID 106648982) is [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine is CC(C)SCC(NN)C1=CCCCC1.
What is the InChIKey of [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine?
The InChIKey is PRDVBRWFKZFTSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2S/c1-9(2)14-8-11(13-12)10-6-4-3-5-7-10/h6,9,11,13H,3-5,7-8,12H2,1-2H3.
What are the key properties of [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine?
[1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine has a molecular weight of 214.38 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexen-1-yl)-2-propan-2-ylsulfanylethyl]hydrazine is sourced from PubChem (CID 106648982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).