1-ethylsulfanylnonan-2-ylhydrazine

C11H26N2S — CID 105225292

IUPAC1-ethylsulfanylnonan-2-ylhydrazine
SMILESCCCCCCCC(CSCC)NN
InChIInChI=1S/C11H26N2S/c1-3-5-6-7-8-9-11(13-12)10-14-4-2/h11,13H,3-10,12H2,1-2H3
InChIKeyNXQBPHQNRHEZLQ-UHFFFAOYSA-N
MW218.41 g/mol
LogP2.93
Rot. Bonds10

About 1-ethylsulfanylnonan-2-ylhydrazine

1-ethylsulfanylnonan-2-ylhydrazine (PubChem CID 105225292) has the molecular formula C11H26N2S and a molecular weight of 218.41 g/mol. Its IUPAC name is 1-ethylsulfanylnonan-2-ylhydrazine.

Molecular Properties

Compound Name1-ethylsulfanylnonan-2-ylhydrazine
PubChem CID105225292
Molecular FormulaC11H26N2S
Molecular Weight218.41 g/mol
Exact Mass218.18
IUPAC Name1-ethylsulfanylnonan-2-ylhydrazine
SMILESCCCCCCCC(CSCC)NN
InChIInChI=1S/C11H26N2S/c1-3-5-6-7-8-9-11(13-12)10-14-4-2/h11,13H,3-10,12H2,1-2H3
InChIKeyNXQBPHQNRHEZLQ-UHFFFAOYSA-N
XLogP2.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-ethylsulfanylnonan-2-ylhydrazine?
The IUPAC name of 1-ethylsulfanylnonan-2-ylhydrazine (CID 105225292) is 1-ethylsulfanylnonan-2-ylhydrazine.
What is the SMILES notation for 1-ethylsulfanylnonan-2-ylhydrazine?
The canonical SMILES for 1-ethylsulfanylnonan-2-ylhydrazine is CCCCCCCC(CSCC)NN.
What is the InChIKey of 1-ethylsulfanylnonan-2-ylhydrazine?
The InChIKey is NXQBPHQNRHEZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2S/c1-3-5-6-7-8-9-11(13-12)10-14-4-2/h11,13H,3-10,12H2,1-2H3.
What are the key properties of 1-ethylsulfanylnonan-2-ylhydrazine?
1-ethylsulfanylnonan-2-ylhydrazine has a molecular weight of 218.41 g/mol, XLogP of 2.93, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylsulfanylnonan-2-ylhydrazine is sourced from PubChem (CID 105225292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).