[4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine

C13H22N2S — CID 105294254

IUPAC[4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine
SMILESCSc1ccc(C(CCC(C)C)NN)cc1
InChIInChI=1S/C13H22N2S/c1-10(2)4-9-13(15-14)11-5-7-12(16-3)8-6-11/h5-8,10,13,15H,4,9,14H2,1-3H3
InChIKeyHFKQGVCFEADUPG-UHFFFAOYSA-N
MW238.40 g/mol
LogP3.35
Rot. Bonds6

About [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine

[4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine (PubChem CID 105294254) has the molecular formula C13H22N2S and a molecular weight of 238.40 g/mol. Its IUPAC name is [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine.

Molecular Properties

Compound Name[4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine
PubChem CID105294254
Molecular FormulaC13H22N2S
Molecular Weight238.40 g/mol
Exact Mass238.15
IUPAC Name[4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine
SMILESCSc1ccc(C(CCC(C)C)NN)cc1
InChIInChI=1S/C13H22N2S/c1-10(2)4-9-13(15-14)11-5-7-12(16-3)8-6-11/h5-8,10,13,15H,4,9,14H2,1-3H3
InChIKeyHFKQGVCFEADUPG-UHFFFAOYSA-N
XLogP3.35
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 53.35
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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Related Compounds

(4-methyl-1-phenylpentyl)hydrazine
CID 105199155
[2-(4-bromophenyl)-1-(4-methylsulfanylphenyl)ethyl]hydrazine
CID 105284436
5-methyl-1-(4-methylsulfanylphenyl)hexan-1-amine
CID 105028980
3-methyl-N-[1-(4-methylsulfanylphenyl)ethyl]butan-1-amine
CID 43193079
[1-(6-chloro-3-pyridinyl)-4-methylpentyl]hydrazine
CID 105252913
hydrazinyl-(4-methylsulfanylphenyl)methanamine
CID 116947480
N-(5-methylhexan-2-yl)-4-methylsulfanylaniline
CID 43110507
[1-(4-fluorophenyl)-3-methylsulfanylpropyl]hydrazine
CID 105284085
3-methyl-4-(4-methylsulfanylphenyl)pentan-1-amine
CID 83935932
[1-(3-chloro-4-iodophenyl)-4-methylpentyl]hydrazine
CID 103217356
1-(4-ethylsulfanylphenyl)pent-4-enylhydrazine
CID 106850536
[1-(3-methoxy-4-methylphenyl)-4-methylpentyl]hydrazine
CID 105294130

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine?
The IUPAC name of [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine (CID 105294254) is [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine.
What is the SMILES notation for [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine?
The canonical SMILES for [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine is CSc1ccc(C(CCC(C)C)NN)cc1.
What is the InChIKey of [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine?
The InChIKey is HFKQGVCFEADUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2S/c1-10(2)4-9-13(15-14)11-5-7-12(16-3)8-6-11/h5-8,10,13,15H,4,9,14H2,1-3H3.
What are the key properties of [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine?
[4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine has a molecular weight of 238.40 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(4-methylsulfanylphenyl)pentyl]hydrazine is sourced from PubChem (CID 105294254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).