1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine

C8H15BrN4 — CID 105202210

IUPAC1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine
SMILESCCCC(NN)c1c(Br)cnn1C
InChIInChI=1S/C8H15BrN4/c1-3-4-7(12-10)8-6(9)5-11-13(8)2/h5,7,12H,3-4,10H2,1-2H3
InChIKeyKKQFUONTJBCSIE-UHFFFAOYSA-N
MW247.14 g/mol
LogP1.49
Rot. Bonds4

About 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine

1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine (PubChem CID 105202210) has the molecular formula C8H15BrN4 and a molecular weight of 247.14 g/mol. Its IUPAC name is 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine.

Molecular Properties

Compound Name1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine
PubChem CID105202210
Molecular FormulaC8H15BrN4
Molecular Weight247.14 g/mol
Exact Mass246.05
IUPAC Name1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine
SMILESCCCC(NN)c1c(Br)cnn1C
InChIInChI=1S/C8H15BrN4/c1-3-4-7(12-10)8-6(9)5-11-13(8)2/h5,7,12H,3-4,10H2,1-2H3
InChIKeyKKQFUONTJBCSIE-UHFFFAOYSA-N
XLogP1.49
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.14
LogP ≤ 51.49
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-1-methylpyrazol-5-yl)-N-propylbutan-1-amine
CID 114647947
1-[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]butylhydrazine
CID 105202253
[1-(4-bromo-1-methylpyrazol-5-yl)-2-methoxypentyl]hydrazine
CID 105271805
1-(4-bromo-1-methylpyrazol-5-yl)-N-ethylpentan-1-amine
CID 114657465
1-(4-bromo-1-methylpyrazol-5-yl)-N-methylpropan-1-amine
CID 83840801
[1-(4-bromo-1-methylpyrazol-5-yl)-2-ethylbutyl]hydrazine
CID 105342070
[1-(4-bromo-1-methylpyrazol-5-yl)-2-pyridin-2-ylethyl]hydrazine
CID 105199943
[1-(4-bromo-1-methylpyrazol-5-yl)-2,2-diethoxyethyl]hydrazine
CID 105246443
1-(4-bromo-1-methylpyrazol-5-yl)-N-ethyl-N',N'-dimethylpropane-1,3-diamine
CID 114659492
1-(4-bromo-1-propan-2-ylpyrazol-5-yl)nonylhydrazine
CID 105337039
1-(4-bromo-1-methylpyrazol-5-yl)-2-methyl-N-propylpentan-1-amine
CID 105054370
1-(4-bromo-1-methylpyrazol-5-yl)-N',N'-diethyl-N-methylpropane-1,3-diamine
CID 114657146

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine?
The IUPAC name of 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine (CID 105202210) is 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine.
What is the SMILES notation for 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine?
The canonical SMILES for 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine is CCCC(NN)c1c(Br)cnn1C.
What is the InChIKey of 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine?
The InChIKey is KKQFUONTJBCSIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15BrN4/c1-3-4-7(12-10)8-6(9)5-11-13(8)2/h5,7,12H,3-4,10H2,1-2H3.
What are the key properties of 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine?
1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine has a molecular weight of 247.14 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-1-methylpyrazol-5-yl)butylhydrazine is sourced from PubChem (CID 105202210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).