[1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine

C11H21BrN4O — CID 105271124

IUPAC[1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
SMILESCCOC(CC)C(NN)c1c(Br)cnn1CC
InChIInChI=1S/C11H21BrN4O/c1-4-9(17-6-3)10(15-13)11-8(12)7-14-16(11)5-2/h7,9-10,15H,4-6,13H2,1-3H3
InChIKeyGMXPBBRSNOGNGJ-UHFFFAOYSA-N
MW305.22 g/mol
LogP1.99
Rot. Bonds7

About [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine

[1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine (PubChem CID 105271124) has the molecular formula C11H21BrN4O and a molecular weight of 305.22 g/mol. Its IUPAC name is [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
PubChem CID105271124
Molecular FormulaC11H21BrN4O
Molecular Weight305.22 g/mol
Exact Mass304.09
IUPAC Name[1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
SMILESCCOC(CC)C(NN)c1c(Br)cnn1CC
InChIInChI=1S/C11H21BrN4O/c1-4-9(17-6-3)10(15-13)11-8(12)7-14-16(11)5-2/h7,9-10,15H,4-6,13H2,1-3H3
InChIKeyGMXPBBRSNOGNGJ-UHFFFAOYSA-N
XLogP1.99
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.22
LogP ≤ 51.99
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-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxy-N-methylpentan-1-amine
CID 114661088
[1-(4-bromo-1-ethylpyrazol-5-yl)-2-methoxy-3-methylbutyl]hydrazine
CID 105272153
[1-(4-bromo-1-ethylpyrazol-5-yl)-2-phenylbutyl]hydrazine
CID 105336192
[1-[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-2-ethoxypropyl]hydrazine
CID 105222964
[1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxybutyl]hydrazine
CID 105270630
[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
CID 105271122
[1-(4-bromo-1-methylpyrazol-5-yl)-2,2-diethoxyethyl]hydrazine
CID 105246443
2-ethoxy-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylbutan-1-amine
CID 114661034
2-[4-bromo-5-(2-ethoxy-1-hydrazinyl-3-methylbutyl)pyrazol-1-yl]-N,N-dimethylethanamine
CID 105272360
[1-(4-bromo-1-propylpyrazol-5-yl)-2-methylpropyl]hydrazine
CID 105199703
[(4-bromo-1-ethylpyrazol-5-yl)-(2,2,3,3-tetramethylcyclopropyl)methyl]hydrazine
CID 105336237
[1-(4-bromo-1-ethylpyrazol-5-yl)-4-methoxybutyl]hydrazine
CID 105225084

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The IUPAC name of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine (CID 105271124) is [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The canonical SMILES for [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine is CCOC(CC)C(NN)c1c(Br)cnn1CC.
What is the InChIKey of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
The InChIKey is GMXPBBRSNOGNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21BrN4O/c1-4-9(17-6-3)10(15-13)11-8(12)7-14-16(11)5-2/h7,9-10,15H,4-6,13H2,1-3H3.
What are the key properties of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine?
[1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine has a molecular weight of 305.22 g/mol, XLogP of 1.99, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-1-ethylpyrazol-5-yl)-2-ethoxybutyl]hydrazine is sourced from PubChem (CID 105271124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).