[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine

C13H18BrN5 — CID 102813227

IUPAC[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCCc1nn(C)cc1C(Cc1ccc(Br)cn1)NN
InChIInChI=1S/C13H18BrN5/c1-3-12-11(8-19(2)18-12)13(17-15)6-10-5-4-9(14)7-16-10/h4-5,7-8,13,17H,3,6,15H2,1-2H3
InChIKeyNKSKWWQVQRAFIQ-UHFFFAOYSA-N
MW324.23 g/mol
LogP1.89
Rot. Bonds5

About [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine

[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 102813227) has the molecular formula C13H18BrN5 and a molecular weight of 324.23 g/mol. Its IUPAC name is [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
PubChem CID102813227
Molecular FormulaC13H18BrN5
Molecular Weight324.23 g/mol
Exact Mass323.07
IUPAC Name[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
SMILESCCc1nn(C)cc1C(Cc1ccc(Br)cn1)NN
InChIInChI=1S/C13H18BrN5/c1-3-12-11(8-19(2)18-12)13(17-15)6-10-5-4-9(14)7-16-10/h4-5,7-8,13,17H,3,6,15H2,1-2H3
InChIKeyNKSKWWQVQRAFIQ-UHFFFAOYSA-N
XLogP1.89
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.23
LogP ≤ 51.89
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-(3-ethyl-1-methylpyrazol-4-yl)-2-(5-ethyl-2-pyridinyl)-N-methylethanamine
CID 102812652
[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 102813123
[1-(5-bromo-2-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105267672
[2-(2-chloro-4-methylphenyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 106868302
[2-(5-bromo-2-pyridinyl)-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105334600
[2-(5-bromo-2-pyridinyl)-1-(2,4-difluoro-5-methylphenyl)ethyl]hydrazine
CID 105334604
1-(3-ethyl-1-methylpyrazol-4-yl)decylhydrazine
CID 102813033
[2-(5-bromo-2-pyridinyl)-1-(1H-1,2,4-triazol-5-yl)ethyl]hydrazine
CID 105230433
[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine
CID 102813154
[1-(5-bromo-2-pyridinyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105267716
4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline
CID 105263426
[1-(3-ethyl-1-methylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103026081

Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine (CID 102813227) is [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine is CCc1nn(C)cc1C(Cc1ccc(Br)cn1)NN.
What is the InChIKey of [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is NKSKWWQVQRAFIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18BrN5/c1-3-12-11(8-19(2)18-12)13(17-15)6-10-5-4-9(14)7-16-10/h4-5,7-8,13,17H,3,6,15H2,1-2H3.
What are the key properties of [2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine?
[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 324.23 g/mol, XLogP of 1.89, 5 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-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 102813227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).