[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine

C13H16Br2N4 — CID 105291385

IUPAC[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1cc(CC(NN)c2cc(Br)ccc2Br)cn1
InChIInChI=1S/C13H16Br2N4/c1-2-19-8-9(7-17-19)5-13(18-16)11-6-10(14)3-4-12(11)15/h3-4,6-8,13,18H,2,5,16H2,1H3
InChIKeyPVOYDKKDWROHPG-UHFFFAOYSA-N
MW388.11 g/mol
LogP3.18
Rot. Bonds5

About [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine

[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105291385) has the molecular formula C13H16Br2N4 and a molecular weight of 388.11 g/mol. Its IUPAC name is [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105291385
Molecular FormulaC13H16Br2N4
Molecular Weight388.11 g/mol
Exact Mass385.97
IUPAC Name[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
SMILESCCn1cc(CC(NN)c2cc(Br)ccc2Br)cn1
InChIInChI=1S/C13H16Br2N4/c1-2-19-8-9(7-17-19)5-13(18-16)11-6-10(14)3-4-12(11)15/h3-4,6-8,13,18H,2,5,16H2,1H3
InChIKeyPVOYDKKDWROHPG-UHFFFAOYSA-N
XLogP3.18
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.11
LogP ≤ 53.18
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-(2,4-dibromophenyl)-N-ethyl-2-(1-ethylpyrazol-4-yl)ethanamine
CID 107945297
1-(5-bromo-2-chlorophenyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 115822181
1-(4-bromo-2-chlorophenyl)-2-(1-ethylpyrazol-4-yl)-N-methylethanamine
CID 115822078
[1-(2,4-dichlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291296
[1-(2,3-dimethylphenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291272
N-[1-(4-bromo-2-chlorophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 115822076
[1-(2,5-dibromophenyl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105283783
[1-(1-benzothiophen-3-yl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291375
[1-(2,5-dibromophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312747
[1-(2-chloro-4-pyridinyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105252663
[2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(2,5-dibromophenyl)ethyl]hydrazine
CID 105316977
1-(2,5-dibromophenyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 115822012

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine (CID 105291385) is [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine is CCn1cc(CC(NN)c2cc(Br)ccc2Br)cn1.
What is the InChIKey of [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is PVOYDKKDWROHPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16Br2N4/c1-2-19-8-9(7-17-19)5-13(18-16)11-6-10(14)3-4-12(11)15/h3-4,6-8,13,18H,2,5,16H2,1H3.
What are the key properties of [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine?
[1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 388.11 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dibromophenyl)-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105291385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).