4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline

C15H19BrN4 — CID 105263426

IUPAC4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline
SMILESCCc1ccc(CC(NN)c2cc(Br)ccc2N)nc1
InChIInChI=1S/C15H19BrN4/c1-2-10-3-5-12(19-9-10)8-15(20-18)13-7-11(16)4-6-14(13)17/h3-7,9,15,20H,2,8,17-18H2,1H3
InChIKeyZPCRQHBJGFRYEA-UHFFFAOYSA-N
MW335.25 g/mol
LogP2.74
Rot. Bonds5

About 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline

4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline (PubChem CID 105263426) has the molecular formula C15H19BrN4 and a molecular weight of 335.25 g/mol. Its IUPAC name is 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline.

Molecular Properties

Compound Name4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline
PubChem CID105263426
Molecular FormulaC15H19BrN4
Molecular Weight335.25 g/mol
Exact Mass334.08
IUPAC Name4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline
SMILESCCc1ccc(CC(NN)c2cc(Br)ccc2N)nc1
InChIInChI=1S/C15H19BrN4/c1-2-10-3-5-12(19-9-10)8-15(20-18)13-7-11(16)4-6-14(13)17/h3-7,9,15,20H,2,8,17-18H2,1H3
InChIKeyZPCRQHBJGFRYEA-UHFFFAOYSA-N
XLogP2.74
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.25
LogP ≤ 52.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(4-bromo-2-fluorophenyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105280856
[1-(5-bromo-2-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105267672
1-(2,5-dibromophenyl)-2-(5-ethyl-2-pyridinyl)ethanol
CID 115822341
[2-(5-ethyl-2-pyridinyl)-1-(2-methylphenyl)ethyl]hydrazine
CID 105200362
[1-(4-bromophenyl)-3-(5-ethyl-2-pyridinyl)propan-2-yl]hydrazine
CID 105195480
1-(5-bromo-2-fluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanol
CID 79740221
[2-(5-ethyl-2-pyridinyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203594
[1-(2-chloro-4-fluorophenyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105215317
[2-(5-bromo-2-pyridinyl)-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105334600
1-(4-bromo-2-methylphenyl)-2-(5-ethyl-2-pyridinyl)ethanol
CID 115822213
4-bromo-2-(1-hydrazinyl-2-pyridin-3-ylethyl)aniline
CID 105263506
[1-(3,4-dichlorophenyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105257061

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline?
The IUPAC name of 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline (CID 105263426) is 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline.
What is the SMILES notation for 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline?
The canonical SMILES for 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline is CCc1ccc(CC(NN)c2cc(Br)ccc2N)nc1.
What is the InChIKey of 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline?
The InChIKey is ZPCRQHBJGFRYEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrN4/c1-2-10-3-5-12(19-9-10)8-15(20-18)13-7-11(16)4-6-14(13)17/h3-7,9,15,20H,2,8,17-18H2,1H3.
What are the key properties of 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline?
4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline has a molecular weight of 335.25 g/mol, XLogP of 2.74, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-[2-(5-ethyl-2-pyridinyl)-1-hydrazinylethyl]aniline is sourced from PubChem (CID 105263426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).