[2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine

C14H26N4S — CID 105227740

IUPAC[2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine
SMILESCCCn1nccc1C(CSC1CCCCC1)NN
InChIInChI=1S/C14H26N4S/c1-2-10-18-14(8-9-16-18)13(17-15)11-19-12-6-4-3-5-7-12/h8-9,12-13,17H,2-7,10-11,15H2,1H3
InChIKeyOKYPPYYTEQVZOL-UHFFFAOYSA-N
MW282.46 g/mol
LogP2.86
Rot. Bonds7

About [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine

[2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105227740) has the molecular formula C14H26N4S and a molecular weight of 282.46 g/mol. Its IUPAC name is [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105227740
Molecular FormulaC14H26N4S
Molecular Weight282.46 g/mol
Exact Mass282.19
IUPAC Name[2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine
SMILESCCCn1nccc1C(CSC1CCCCC1)NN
InChIInChI=1S/C14H26N4S/c1-2-10-18-14(8-9-16-18)13(17-15)11-19-12-6-4-3-5-7-12/h8-9,12-13,17H,2-7,10-11,15H2,1H3
InChIKeyOKYPPYYTEQVZOL-UHFFFAOYSA-N
XLogP2.86
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.46
LogP ≤ 52.86
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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Frequently Asked Questions

What is the IUPAC name of [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine (CID 105227740) is [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine is CCCn1nccc1C(CSC1CCCCC1)NN.
What is the InChIKey of [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is OKYPPYYTEQVZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4S/c1-2-10-18-14(8-9-16-18)13(17-15)11-19-12-6-4-3-5-7-12/h8-9,12-13,17H,2-7,10-11,15H2,1H3.
What are the key properties of [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine?
[2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 282.46 g/mol, XLogP of 2.86, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclohexylsulfanyl-1-(2-propylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105227740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).