[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine

C12H21N3OS — CID 105330104

IUPAC[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine
SMILESCCCOc1cncc(C(CCSC)NN)c1
InChIInChI=1S/C12H21N3OS/c1-3-5-16-11-7-10(8-14-9-11)12(15-13)4-6-17-2/h7-9,12,15H,3-6,13H2,1-2H3
InChIKeySRQDUQJYFDQXQD-UHFFFAOYSA-N
MW255.39 g/mol
LogP2.13
Rot. Bonds8

About [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine

[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine (PubChem CID 105330104) has the molecular formula C12H21N3OS and a molecular weight of 255.39 g/mol. Its IUPAC name is [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine.

Molecular Properties

Compound Name[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine
PubChem CID105330104
Molecular FormulaC12H21N3OS
Molecular Weight255.39 g/mol
Exact Mass255.14
IUPAC Name[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine
SMILESCCCOc1cncc(C(CCSC)NN)c1
InChIInChI=1S/C12H21N3OS/c1-3-5-16-11-7-10(8-14-9-11)12(15-13)4-6-17-2/h7-9,12,15H,3-6,13H2,1-2H3
InChIKeySRQDUQJYFDQXQD-UHFFFAOYSA-N
XLogP2.13
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.39
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[2-phenyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
CID 105195381
[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
CID 105227942
[2-(oxan-2-yl)-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
CID 105267561
N-methyl-1-(5-propoxy-3-pyridinyl)nonan-1-amine
CID 105026682
[(2-methylsulfanylphenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330102
1-(5-methoxy-3-pyridinyl)heptylhydrazine
CID 105329844
4-methoxy-N-methyl-1-(5-propoxy-3-pyridinyl)pentan-1-amine
CID 105175683
[4-ethoxy-1-(5-methoxy-3-pyridinyl)butyl]hydrazine
CID 105329751
[(4-methylthiadiazol-5-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330043
[(5-propoxy-3-pyridinyl)-thiophen-2-ylmethyl]hydrazine
CID 105193764
4-ethoxy-1-(5-propoxy-3-pyridinyl)butan-1-ol
CID 105121586
[(4,5-dimethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330062

Frequently Asked Questions

What is the IUPAC name of [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine?
The IUPAC name of [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine (CID 105330104) is [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine.
What is the SMILES notation for [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine?
The canonical SMILES for [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine is CCCOc1cncc(C(CCSC)NN)c1.
What is the InChIKey of [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine?
The InChIKey is SRQDUQJYFDQXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3OS/c1-3-5-16-11-7-10(8-14-9-11)12(15-13)4-6-17-2/h7-9,12,15H,3-6,13H2,1-2H3.
What are the key properties of [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine?
[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine has a molecular weight of 255.39 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine is sourced from PubChem (CID 105330104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).