[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine

C16H27N3OS — CID 105227942

IUPAC[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
SMILESCCCOc1cncc(C(CSC2CCCCC2)NN)c1
InChIInChI=1S/C16H27N3OS/c1-2-8-20-14-9-13(10-18-11-14)16(19-17)12-21-15-6-4-3-5-7-15/h9-11,15-16,19H,2-8,12,17H2,1H3
InChIKeyCOXJHUVRJLEFOB-UHFFFAOYSA-N
MW309.48 g/mol
LogP3.44
Rot. Bonds8

About [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine

[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine (PubChem CID 105227942) has the molecular formula C16H27N3OS and a molecular weight of 309.48 g/mol. Its IUPAC name is [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
PubChem CID105227942
Molecular FormulaC16H27N3OS
Molecular Weight309.48 g/mol
Exact Mass309.19
IUPAC Name[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
SMILESCCCOc1cncc(C(CSC2CCCCC2)NN)c1
InChIInChI=1S/C16H27N3OS/c1-2-8-20-14-9-13(10-18-11-14)16(19-17)12-21-15-6-4-3-5-7-15/h9-11,15-16,19H,2-8,12,17H2,1H3
InChIKeyCOXJHUVRJLEFOB-UHFFFAOYSA-N
XLogP3.44
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.48
LogP ≤ 53.44
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-(oxan-2-yl)-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
CID 105267561
[3-methylsulfanyl-1-(5-propoxy-3-pyridinyl)propyl]hydrazine
CID 105330104
[2-phenyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine
CID 105195381
[2-cyclohexylsulfanyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105227705
[2-cyclopentylsulfanyl-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105227501
2-cyclohexylsulfanyl-1-(5-fluoro-3-pyridinyl)-N-methylethanamine
CID 65144532
N-methyl-1-(5-propoxy-3-pyridinyl)nonan-1-amine
CID 105026682
[2-(4-bromophenyl)sulfanyl-1-(5-ethoxy-3-pyridinyl)ethyl]hydrazine
CID 105235964
N-ethyl-2-(1-methoxycyclobutyl)-1-(5-propoxy-3-pyridinyl)ethanamine
CID 103559738
[2-cycloheptyl-1-(4-propoxyphenyl)ethyl]hydrazine
CID 105303625
4-methoxy-N-methyl-1-(5-propoxy-3-pyridinyl)pentan-1-amine
CID 105175683
[(4-methylthiophen-3-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105251939

Frequently Asked Questions

What is the IUPAC name of [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine (CID 105227942) is [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine is CCCOc1cncc(C(CSC2CCCCC2)NN)c1.
What is the InChIKey of [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine?
The InChIKey is COXJHUVRJLEFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3OS/c1-2-8-20-14-9-13(10-18-11-14)16(19-17)12-21-15-6-4-3-5-7-15/h9-11,15-16,19H,2-8,12,17H2,1H3.
What are the key properties of [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine?
[2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine has a molecular weight of 309.48 g/mol, XLogP of 3.44, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclohexylsulfanyl-1-(5-propoxy-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105227942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).