[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine

C13H24N4S — CID 105288638

IUPAC[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine
SMILESCCCn1cc(C(CC2CCSCC2)NN)cn1
InChIInChI=1S/C13H24N4S/c1-2-5-17-10-12(9-15-17)13(16-14)8-11-3-6-18-7-4-11/h9-11,13,16H,2-8,14H2,1H3
InChIKeyBTOCFYQRPUYJKZ-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.33
Rot. Bonds6

About [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine

[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine (PubChem CID 105288638) has the molecular formula C13H24N4S and a molecular weight of 268.43 g/mol. Its IUPAC name is [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine
PubChem CID105288638
Molecular FormulaC13H24N4S
Molecular Weight268.43 g/mol
Exact Mass268.17
IUPAC Name[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine
SMILESCCCn1cc(C(CC2CCSCC2)NN)cn1
InChIInChI=1S/C13H24N4S/c1-2-5-17-10-12(9-15-17)13(16-14)8-11-3-6-18-7-4-11/h9-11,13,16H,2-8,14H2,1H3
InChIKeyBTOCFYQRPUYJKZ-UHFFFAOYSA-N
XLogP2.33
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.33
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-cyclopentyl-N-ethyl-1-(1-propylpyrazol-4-yl)ethanamine
CID 115807398
[(4-propylcyclohexyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105232223
1-(1-propylpyrazol-4-yl)but-3-enylhydrazine
CID 105269651
2-cyclobutyl-1-(1-ethylpyrazol-4-yl)-N-methylethanamine
CID 103168314
(1-propylpyrazol-4-yl)-(thiolan-3-yl)methanol
CID 105080812
[3-ethoxy-1-(1-propylpyrazol-4-yl)propyl]hydrazine
CID 105288600
[1-(4-fluorophenyl)-2-(thian-4-yl)ethyl]hydrazine
CID 105284174
[1-(3-ethylphenyl)-2-(thian-4-yl)ethyl]hydrazine
CID 105326402
[(1-ethylpyrazol-4-yl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232222
cycloheptyl-(1-propylpyrazol-4-yl)methanol
CID 65398920
[2,2-dimethyl-1-(1-propylpyrazol-4-yl)propyl]hydrazine
CID 105203000
3-cyclopropyl-1-(1-propylpyrazol-4-yl)propan-1-ol
CID 106590646

Frequently Asked Questions

What is the IUPAC name of [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine (CID 105288638) is [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine is CCCn1cc(C(CC2CCSCC2)NN)cn1.
What is the InChIKey of [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine?
The InChIKey is BTOCFYQRPUYJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4S/c1-2-5-17-10-12(9-15-17)13(16-14)8-11-3-6-18-7-4-11/h9-11,13,16H,2-8,14H2,1H3.
What are the key properties of [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine?
[1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine has a molecular weight of 268.43 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-propylpyrazol-4-yl)-2-(thian-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105288638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).