[1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine

C11H19BrN4O — CID 105266145

IUPAC[1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine
SMILESCCn1ncc(Br)c1C(CC1CCOC1)NN
InChIInChI=1S/C11H19BrN4O/c1-2-16-11(9(12)6-14-16)10(15-13)5-8-3-4-17-7-8/h6,8,10,15H,2-5,7,13H2,1H3
InChIKeyANYYKWRDDWRUNT-UHFFFAOYSA-N
MW303.20 g/mol
LogP1.60
Rot. Bonds5

About [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine

[1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine (PubChem CID 105266145) has the molecular formula C11H19BrN4O and a molecular weight of 303.20 g/mol. Its IUPAC name is [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine
PubChem CID105266145
Molecular FormulaC11H19BrN4O
Molecular Weight303.20 g/mol
Exact Mass302.07
IUPAC Name[1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine
SMILESCCn1ncc(Br)c1C(CC1CCOC1)NN
InChIInChI=1S/C11H19BrN4O/c1-2-16-11(9(12)6-14-16)10(15-13)5-8-3-4-17-7-8/h6,8,10,15H,2-5,7,13H2,1H3
InChIKeyANYYKWRDDWRUNT-UHFFFAOYSA-N
XLogP1.60
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.20
LogP ≤ 51.60
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-[2-(dimethylamino)ethyl]pyrazol-5-yl]-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 114660263
[1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-2-(oxolan-3-yl)ethyl]hydrazine
CID 105266007
N-[(4-bromo-1-ethylpyrazol-5-yl)-(oxolan-3-yl)methyl]ethanamine
CID 114654743
[1-[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-2-cyclopropylethyl]hydrazine
CID 105254185
[1-(4-chloro-1-ethylpyrazol-5-yl)-2-cyclopentylethyl]hydrazine
CID 105336401
1-(2-ethylpyrazol-3-yl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 103987048
[1-(4-chloro-1-ethylpyrazol-5-yl)-2-cyclohexylethyl]hydrazine
CID 105336353
[(4-bromo-1-ethylpyrazol-5-yl)-cyclopentylmethyl]hydrazine
CID 105204420
1-(4-bromo-1-ethylpyrazol-5-yl)-2-cyclohexylethanol
CID 114637053
[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
CID 103170830
3-(4-bromo-1-ethylpyrazol-5-yl)-N,N-diethyl-3-hydrazinylpropan-1-amine
CID 105244143
[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-(oxolan-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine (CID 105266145) is [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine is CCn1ncc(Br)c1C(CC1CCOC1)NN.
What is the InChIKey of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine?
The InChIKey is ANYYKWRDDWRUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19BrN4O/c1-2-16-11(9(12)6-14-16)10(15-13)5-8-3-4-17-7-8/h6,8,10,15H,2-5,7,13H2,1H3.
What are the key properties of [1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine?
[1-(4-bromo-1-ethylpyrazol-5-yl)-2-(oxolan-3-yl)ethyl]hydrazine has a molecular weight of 303.20 g/mol, XLogP of 1.60, 5 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-(oxolan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105266145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).