[(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine

C13H14BrFN4O — CID 114270784

IUPAC[(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESCCOc1nccc(C(NN)c2ccc(Br)cn2)c1F
InChIInChI=1S/C13H14BrFN4O/c1-2-20-13-11(15)9(5-6-17-13)12(19-16)10-4-3-8(14)7-18-10/h3-7,12,19H,2,16H2,1H3
InChIKeyNUOQCYBMRUVMJS-UHFFFAOYSA-N
MW341.18 g/mol
LogP2.33
Rot. Bonds5

About [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine

[(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine (PubChem CID 114270784) has the molecular formula C13H14BrFN4O and a molecular weight of 341.18 g/mol. Its IUPAC name is [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine
PubChem CID114270784
Molecular FormulaC13H14BrFN4O
Molecular Weight341.18 g/mol
Exact Mass340.03
IUPAC Name[(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine
SMILESCCOc1nccc(C(NN)c2ccc(Br)cn2)c1F
InChIInChI=1S/C13H14BrFN4O/c1-2-20-13-11(15)9(5-6-17-13)12(19-16)10-4-3-8(14)7-18-10/h3-7,12,19H,2,16H2,1H3
InChIKeyNUOQCYBMRUVMJS-UHFFFAOYSA-N
XLogP2.33
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.18
LogP ≤ 52.33
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

[(4-bromo-3-chloro-2-fluorophenyl)-(5-bromo-2-pyridinyl)methyl]hydrazine
CID 106765388
[(5-bromo-2-pyridinyl)-(4-ethylphenyl)methyl]hydrazine
CID 105267871
[1-(5-bromo-2-pyridinyl)-2-ethoxyethyl]hydrazine
CID 105267714
[(5-bromo-2-pyridinyl)-(4-bromothiophen-3-yl)methyl]hydrazine
CID 105267652
[(5-bromo-2-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methyl]hydrazine
CID 105267904
[(5-bromo-2-pyridinyl)-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105267665
N-[(5-bromo-2-pyridinyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104516092
[(5-bromo-2-pyridinyl)-(3-methylphenyl)methyl]hydrazine
CID 105267734
[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105267769
[(2-ethyl-5-methylpyrazol-3-yl)-(3-fluoro-2-methoxy-4-pyridinyl)methyl]hydrazine
CID 114270797
[1-(5-bromo-2-pyridinyl)-3-ethylpentyl]hydrazine
CID 105267903
[(5-bromo-2-pyridinyl)-thiophen-3-ylmethyl]hydrazine
CID 105267641

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine (CID 114270784) is [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine is CCOc1nccc(C(NN)c2ccc(Br)cn2)c1F.
What is the InChIKey of [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine?
The InChIKey is NUOQCYBMRUVMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrFN4O/c1-2-20-13-11(15)9(5-6-17-13)12(19-16)10-4-3-8(14)7-18-10/h3-7,12,19H,2,16H2,1H3.
What are the key properties of [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine?
[(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine has a molecular weight of 341.18 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-2-pyridinyl)-(2-ethoxy-3-fluoro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 114270784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).