[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine

C16H30N4S — CID 105227639

IUPAC[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine
SMILESCCC(CC)n1ccc(CC(CSC2CCCC2)NN)n1
InChIInChI=1S/C16H30N4S/c1-3-15(4-2)20-10-9-13(19-20)11-14(18-17)12-21-16-7-5-6-8-16/h9-10,14-16,18H,3-8,11-12,17H2,1-2H3
InChIKeyUMAZWXBPHZKHPY-UHFFFAOYSA-N
MW310.51 g/mol
LogP3.29
Rot. Bonds9

About [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine

[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine (PubChem CID 105227639) has the molecular formula C16H30N4S and a molecular weight of 310.51 g/mol. Its IUPAC name is [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine
PubChem CID105227639
Molecular FormulaC16H30N4S
Molecular Weight310.51 g/mol
Exact Mass310.22
IUPAC Name[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine
SMILESCCC(CC)n1ccc(CC(CSC2CCCC2)NN)n1
InChIInChI=1S/C16H30N4S/c1-3-15(4-2)20-10-9-13(19-20)11-14(18-17)12-21-16-7-5-6-8-16/h9-10,14-16,18H,3-8,11-12,17H2,1-2H3
InChIKeyUMAZWXBPHZKHPY-UHFFFAOYSA-N
XLogP3.29
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.51
LogP ≤ 53.29
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

1-cyclopentylsulfanyl-N-methyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 65139202
[1-(2-methylpropylsulfanyl)-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105226952
[1-cyclohexyl-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105201952
1-(1-pentan-3-ylpyrazol-3-yl)heptan-2-ylhydrazine
CID 105313398
1-cycloheptyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 104991829
1-cyclohexyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 104991709
[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105313440
[1-cyclopentylsulfanyl-3-(1-ethylimidazol-2-yl)propan-2-yl]hydrazine
CID 105227664
[1-(1-butan-2-ylpyrazol-3-yl)-4-cyclohexylbutan-2-yl]hydrazine
CID 105312574
[1-cyclopentylsulfanyl-3-(4-methylphenyl)propan-2-yl]hydrazine
CID 105227574
(1-cyclohexylsulfanyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl)hydrazine
CID 105227723
[1-(oxan-3-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105230091

Frequently Asked Questions

What is the IUPAC name of [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine?
The IUPAC name of [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine (CID 105227639) is [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine is CCC(CC)n1ccc(CC(CSC2CCCC2)NN)n1.
What is the InChIKey of [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine?
The InChIKey is UMAZWXBPHZKHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4S/c1-3-15(4-2)20-10-9-13(19-20)11-14(18-17)12-21-16-7-5-6-8-16/h9-10,14-16,18H,3-8,11-12,17H2,1-2H3.
What are the key properties of [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine?
[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine has a molecular weight of 310.51 g/mol, XLogP of 3.29, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 105227639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).