1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine

C11H26N2S — CID 122605735

IUPAC1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine
SMILESCCCC(C)C(CCC)SC(C)NN
InChIInChI=1S/C11H26N2S/c1-5-7-9(3)11(8-6-2)14-10(4)13-12/h9-11,13H,5-8,12H2,1-4H3
InChIKeyCINYNRBNGOPTAO-UHFFFAOYSA-N
MW218.41 g/mol
LogP3.13
Rot. Bonds8

About 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine

1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine (PubChem CID 122605735) has the molecular formula C11H26N2S and a molecular weight of 218.41 g/mol. Its IUPAC name is 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine.

Molecular Properties

Compound Name1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine
PubChem CID122605735
Molecular FormulaC11H26N2S
Molecular Weight218.41 g/mol
Exact Mass218.18
IUPAC Name1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine
SMILESCCCC(C)C(CCC)SC(C)NN
InChIInChI=1S/C11H26N2S/c1-5-7-9(3)11(8-6-2)14-10(4)13-12/h9-11,13H,5-8,12H2,1-4H3
InChIKeyCINYNRBNGOPTAO-UHFFFAOYSA-N
XLogP3.13
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(3S,4S)-2,4-dimethylheptan-3-yl]hydrazine
CID 124537670
(1,1-difluoro-3-methylhexan-2-yl)hydrazine
CID 107895304
3,3,5-trimethyloctan-4-ylhydrazine
CID 107896017
(2-cyclopropyl-4-methylheptan-3-yl)hydrazine
CID 107895883
(1-cyclopentyl-2-methylpentyl)hydrazine
CID 105282461
(4-methyl-1-methylsulfonylheptan-3-yl)hydrazine
CID 114985152
(3-ethoxy-2,5-dimethyloctan-4-yl)hydrazine
CID 107895343
2,2-dimethylhexan-3-ylhydrazine;hydrochloride
CID 175264360
3,4-dimethyl-N-propan-2-ylheptan-2-amine
CID 107886809
(3R)-3,4-dimethylheptane
CID 59819300
[1-(1-ethylcyclopentyl)-2-methylpentyl]hydrazine
CID 107896028
2,2,5-trimethyloctan-4-amine
CID 107893664

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine?
The IUPAC name of 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine (CID 122605735) is 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine.
What is the SMILES notation for 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine?
The canonical SMILES for 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine is CCCC(C)C(CCC)SC(C)NN.
What is the InChIKey of 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine?
The InChIKey is CINYNRBNGOPTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2S/c1-5-7-9(3)11(8-6-2)14-10(4)13-12/h9-11,13H,5-8,12H2,1-4H3.
What are the key properties of 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine?
1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine has a molecular weight of 218.41 g/mol, XLogP of 3.13, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyloctan-4-ylsulfanyl)ethylhydrazine is sourced from PubChem (CID 122605735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).