[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine

C18H28N2S — CID 105227909

IUPAC[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine
SMILESNNC(CSC1CCCCC1)c1ccc(C2CCC2)cc1
InChIInChI=1S/C18H28N2S/c19-20-18(13-21-17-7-2-1-3-8-17)16-11-9-15(10-12-16)14-5-4-6-14/h9-12,14,17-18,20H,1-8,13,19H2
InChIKeyYNYHSEMCRGIKGA-UHFFFAOYSA-N
MW304.50 g/mol
LogP4.52
Rot. Bonds6

About [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine

[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine (PubChem CID 105227909) has the molecular formula C18H28N2S and a molecular weight of 304.50 g/mol. Its IUPAC name is [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine
PubChem CID105227909
Molecular FormulaC18H28N2S
Molecular Weight304.50 g/mol
Exact Mass304.20
IUPAC Name[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine
SMILESNNC(CSC1CCCCC1)c1ccc(C2CCC2)cc1
InChIInChI=1S/C18H28N2S/c19-20-18(13-21-17-7-2-1-3-8-17)16-11-9-15(10-12-16)14-5-4-6-14/h9-12,14,17-18,20H,1-8,13,19H2
InChIKeyYNYHSEMCRGIKGA-UHFFFAOYSA-N
XLogP4.52
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine?
The IUPAC name of [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine (CID 105227909) is [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine is NNC(CSC1CCCCC1)c1ccc(C2CCC2)cc1.
What is the InChIKey of [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine?
The InChIKey is YNYHSEMCRGIKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2S/c19-20-18(13-21-17-7-2-1-3-8-17)16-11-9-15(10-12-16)14-5-4-6-14/h9-12,14,17-18,20H,1-8,13,19H2.
What are the key properties of [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine?
[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine has a molecular weight of 304.50 g/mol, XLogP of 4.52, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine is sourced from PubChem (CID 105227909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).