[2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine

C13H22BrN5 — CID 105247256

IUPAC[2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
SMILESCN1CCN(C)C(C(Cc2ccc(Br)cn2)NN)C1
InChIInChI=1S/C13H22BrN5/c1-18-5-6-19(2)13(9-18)12(17-15)7-11-4-3-10(14)8-16-11/h3-4,8,12-13,17H,5-7,9,15H2,1-2H3
InChIKeyPFVJSAXLXSLWEA-UHFFFAOYSA-N
MW328.26 g/mol
LogP0.46
Rot. Bonds4

About [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine

[2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine (PubChem CID 105247256) has the molecular formula C13H22BrN5 and a molecular weight of 328.26 g/mol. Its IUPAC name is [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
PubChem CID105247256
Molecular FormulaC13H22BrN5
Molecular Weight328.26 g/mol
Exact Mass327.11
IUPAC Name[2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
SMILESCN1CCN(C)C(C(Cc2ccc(Br)cn2)NN)C1
InChIInChI=1S/C13H22BrN5/c1-18-5-6-19(2)13(9-18)12(17-15)7-11-4-3-10(14)8-16-11/h3-4,8,12-13,17H,5-7,9,15H2,1-2H3
InChIKeyPFVJSAXLXSLWEA-UHFFFAOYSA-N
XLogP0.46
TPSA57.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.26
LogP ≤ 50.46
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

[2-(3-bromophenyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105247302
2-(5-bromo-2-pyridinyl)-1-(1,4-dimethyl-1,4-diazepan-2-yl)ethanol
CID 104800533
[2-(3-bromothiophen-2-yl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105247367
[2-(5-bromo-2-pyridinyl)-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethyl]hydrazine
CID 105265764
[2-(5-bromo-2-pyridinyl)-1-(2,2-dimethylcyclopropyl)ethyl]hydrazine
CID 107005841
[2-(5-ethyl-2-pyridinyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446379
[2-(3,5-difluorophenyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105412951
[2-(5-bromo-2-pyridinyl)-1-(oxan-4-yl)ethyl]hydrazine
CID 105229627
[2-(2,5-difluorophenyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105247218
[2-(5-bromo-2-pyridinyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]hydrazine
CID 105218838
[2-(4-bromo-1-ethyl-3-methylpyrazol-5-yl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105247216
[1-(1,4-dimethylpiperazin-2-yl)-3-(1-methylimidazol-2-yl)propyl]hydrazine
CID 105247347

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine (CID 105247256) is [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine is CN1CCN(C)C(C(Cc2ccc(Br)cn2)NN)C1.
What is the InChIKey of [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine?
The InChIKey is PFVJSAXLXSLWEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22BrN5/c1-18-5-6-19(2)13(9-18)12(17-15)7-11-4-3-10(14)8-16-11/h3-4,8,12-13,17H,5-7,9,15H2,1-2H3.
What are the key properties of [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine?
[2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine has a molecular weight of 328.26 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromo-2-pyridinyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105247256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).