1-propylsulfanyldecan-2-ylhydrazine

C13H30N2S — CID 105225668

IUPAC1-propylsulfanyldecan-2-ylhydrazine
SMILESCCCCCCCCC(CSCCC)NN
InChIInChI=1S/C13H30N2S/c1-3-5-6-7-8-9-10-13(15-14)12-16-11-4-2/h13,15H,3-12,14H2,1-2H3
InChIKeyAIYFXWYLMZWFKZ-UHFFFAOYSA-N
MW246.46 g/mol
LogP3.71
Rot. Bonds12

About 1-propylsulfanyldecan-2-ylhydrazine

1-propylsulfanyldecan-2-ylhydrazine (PubChem CID 105225668) has the molecular formula C13H30N2S and a molecular weight of 246.46 g/mol. Its IUPAC name is 1-propylsulfanyldecan-2-ylhydrazine.

Molecular Properties

Compound Name1-propylsulfanyldecan-2-ylhydrazine
PubChem CID105225668
Molecular FormulaC13H30N2S
Molecular Weight246.46 g/mol
Exact Mass246.21
IUPAC Name1-propylsulfanyldecan-2-ylhydrazine
SMILESCCCCCCCCC(CSCCC)NN
InChIInChI=1S/C13H30N2S/c1-3-5-6-7-8-9-10-13(15-14)12-16-11-4-2/h13,15H,3-12,14H2,1-2H3
InChIKeyAIYFXWYLMZWFKZ-UHFFFAOYSA-N
XLogP3.71
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.46
LogP ≤ 53.71
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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Related Compounds

1-ethylsulfanylnonan-2-ylhydrazine
CID 105225292
N-ethyl-1-propylsulfanyloctan-2-amine
CID 65128622
(5-methoxy-1-propylsulfanylpentan-2-yl)hydrazine
CID 105225805
1-propan-2-ylsulfanylnonan-2-ylhydrazine
CID 105226034
1-propan-2-ylsulfanyltetradecan-2-ylhydrazine
CID 105226035
1-propan-2-ylsulfanylundecan-2-ylhydrazine
CID 105226075
N-propyl-1-propylsulfanylheptan-2-amine
CID 65129217
1-propylsulfanylundecan-2-amine
CID 65129364
tridecan-3-ylhydrazine
CID 105201157
pentadecan-3-ylhydrazine
CID 105200968
1-tert-butylsulfanylheptan-2-ylhydrazine
CID 105226571
tridec-1-en-4-ylhydrazine
CID 105269672

Frequently Asked Questions

What is the IUPAC name of 1-propylsulfanyldecan-2-ylhydrazine?
The IUPAC name of 1-propylsulfanyldecan-2-ylhydrazine (CID 105225668) is 1-propylsulfanyldecan-2-ylhydrazine.
What is the SMILES notation for 1-propylsulfanyldecan-2-ylhydrazine?
The canonical SMILES for 1-propylsulfanyldecan-2-ylhydrazine is CCCCCCCCC(CSCCC)NN.
What is the InChIKey of 1-propylsulfanyldecan-2-ylhydrazine?
The InChIKey is AIYFXWYLMZWFKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2S/c1-3-5-6-7-8-9-10-13(15-14)12-16-11-4-2/h13,15H,3-12,14H2,1-2H3.
What are the key properties of 1-propylsulfanyldecan-2-ylhydrazine?
1-propylsulfanyldecan-2-ylhydrazine has a molecular weight of 246.46 g/mol, XLogP of 3.71, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylsulfanyldecan-2-ylhydrazine is sourced from PubChem (CID 105225668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).