[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine

C13H21BrN6S — CID 105314896

IUPAC[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCCc1nnsc1C(Cc1c(Br)c(CC)nn1C)NN
InChIInChI=1S/C13H21BrN6S/c1-4-6-9-13(21-19-17-9)10(16-15)7-11-12(14)8(5-2)18-20(11)3/h10,16H,4-7,15H2,1-3H3
InChIKeyKGSOGAKLQCBEQX-UHFFFAOYSA-N
MW373.32 g/mol
LogP2.30
Rot. Bonds7

About [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine

[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine (PubChem CID 105314896) has the molecular formula C13H21BrN6S and a molecular weight of 373.32 g/mol. Its IUPAC name is [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
PubChem CID105314896
Molecular FormulaC13H21BrN6S
Molecular Weight373.32 g/mol
Exact Mass372.07
IUPAC Name[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCCc1nnsc1C(Cc1c(Br)c(CC)nn1C)NN
InChIInChI=1S/C13H21BrN6S/c1-4-6-9-13(21-19-17-9)10(16-15)7-11-12(14)8(5-2)18-20(11)3/h10,16H,4-7,15H2,1-3H3
InChIKeyKGSOGAKLQCBEQX-UHFFFAOYSA-N
XLogP2.30
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.32
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105105690
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(3-methylimidazol-4-yl)ethyl]hydrazine
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[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-methylphenyl)ethyl]hydrazine
CID 105194397
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(3,5-dibromophenyl)ethyl]hydrazine
CID 107979192
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228761
[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-methylbutan-2-yl]hydrazine
CID 105199615
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(3,4-dimethylphenyl)ethyl]hydrazine
CID 105314872
[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine
CID 105314862
[2-(3-bromothiophen-2-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine
CID 105299495
[1-(3-bromo-5-chlorophenyl)-2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 107948303
[2-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105334082
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(2-chloro-6-fluorophenyl)ethyl]hydrazine
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Frequently Asked Questions

What is the IUPAC name of [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine (CID 105314896) is [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine is CCCc1nnsc1C(Cc1c(Br)c(CC)nn1C)NN.
What is the InChIKey of [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
The InChIKey is KGSOGAKLQCBEQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21BrN6S/c1-4-6-9-13(21-19-17-9)10(16-15)7-11-12(14)8(5-2)18-20(11)3/h10,16H,4-7,15H2,1-3H3.
What are the key properties of [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine?
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine has a molecular weight of 373.32 g/mol, XLogP of 2.30, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-propylthiadiazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105314896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).