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

C13H25BrN4 — CID 105314862

IUPAC[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine
SMILESCCc1nn(C)c(CC(NN)C(CC)CC)c1Br
InChIInChI=1S/C13H25BrN4/c1-5-9(6-2)11(16-15)8-12-13(14)10(7-3)17-18(12)4/h9,11,16H,5-8,15H2,1-4H3
InChIKeyUPZMCWMZMIVRGI-UHFFFAOYSA-N
MW317.28 g/mol
LogP2.56
Rot. Bonds7

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

[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine (PubChem CID 105314862) has the molecular formula C13H25BrN4 and a molecular weight of 317.28 g/mol. Its IUPAC name is [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine
PubChem CID105314862
Molecular FormulaC13H25BrN4
Molecular Weight317.28 g/mol
Exact Mass316.13
IUPAC Name[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine
SMILESCCc1nn(C)c(CC(NN)C(CC)CC)c1Br
InChIInChI=1S/C13H25BrN4/c1-5-9(6-2)11(16-15)8-12-13(14)10(7-3)17-18(12)4/h9,11,16H,5-8,15H2,1-4H3
InChIKeyUPZMCWMZMIVRGI-UHFFFAOYSA-N
XLogP2.56
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.28
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-methylbutan-2-yl]hydrazine
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1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethoxy-N-propylpentan-2-amine
CID 116717324
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-methylphenyl)ethyl]hydrazine
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[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(3,5-dibromophenyl)ethyl]hydrazine
CID 107979192
1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-N,3-dimethyl-4-methylsulfanylbutan-2-amine
CID 114221988
4-bromo-5-[2-(chloromethyl)-3-methylbutyl]-3-ethyl-1-methylpyrazole
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[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
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[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(3-methylimidazol-4-yl)ethyl]hydrazine
CID 105264709
4-bromo-5-(bromomethyl)-3-ethyl-1-methylpyrazole
CID 81223578
1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-N-methylhexan-2-amine
CID 79405447
[2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-1-(4-ethylcyclohexyl)ethyl]hydrazine
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Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine?
The IUPAC name of [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine (CID 105314862) is [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine is CCc1nn(C)c(CC(NN)C(CC)CC)c1Br.
What is the InChIKey of [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine?
The InChIKey is UPZMCWMZMIVRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25BrN4/c1-5-9(6-2)11(16-15)8-12-13(14)10(7-3)17-18(12)4/h9,11,16H,5-8,15H2,1-4H3.
What are the key properties of [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine?
[1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine has a molecular weight of 317.28 g/mol, XLogP of 2.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-3-ethylpentan-2-yl]hydrazine is sourced from PubChem (CID 105314862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).