[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine

C12H12BrN3O — CID 62246032

IUPAC[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine
SMILESNNc1ccc(COc2cccc(Br)c2)cn1
InChIInChI=1S/C12H12BrN3O/c13-10-2-1-3-11(6-10)17-8-9-4-5-12(16-14)15-7-9/h1-7H,8,14H2,(H,15,16)
InChIKeyQYRJPXGCHGLGMG-UHFFFAOYSA-N
MW294.15 g/mol
LogP2.71
Rot. Bonds4

About [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine

[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine (PubChem CID 62246032) has the molecular formula C12H12BrN3O and a molecular weight of 294.15 g/mol. Its IUPAC name is [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine
PubChem CID62246032
Molecular FormulaC12H12BrN3O
Molecular Weight294.15 g/mol
Exact Mass293.02
IUPAC Name[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine
SMILESNNc1ccc(COc2cccc(Br)c2)cn1
InChIInChI=1S/C12H12BrN3O/c13-10-2-1-3-11(6-10)17-8-9-4-5-12(16-14)15-7-9/h1-7H,8,14H2,(H,15,16)
InChIKeyQYRJPXGCHGLGMG-UHFFFAOYSA-N
XLogP2.71
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.15
LogP ≤ 52.71
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

5-[(3-bromophenoxy)methyl]pyridin-2-amine
CID 62193709
4-[(3-bromophenoxy)methyl]benzohydrazide
CID 63575146
[5-(1,3-benzodioxol-5-yloxymethyl)-2-pyridinyl]hydrazine
CID 55051241
[5-[(4-methylsulfanylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 63648050
[5-[(2-bromo-4-chlorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62246224
4-[(6-hydrazinyl-3-pyridinyl)methoxy]benzamide
CID 62244712
[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62246023
N-ethyl-5-[(3-ethylphenoxy)methyl]pyridin-2-amine
CID 62195699
6-[(6-hydrazinyl-3-pyridinyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 62244306
[5-[(4-methylphenyl)methoxy]-2-pyridinyl]hydrazine
CID 135394683
N-[[4-[(3-bromophenoxy)methyl]phenyl]methyl]propan-2-amine
CID 63498401
4-[(3-bromophenoxy)methyl]-1-methylpyrazole
CID 28782443

Frequently Asked Questions

What is the IUPAC name of [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine (CID 62246032) is [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine is NNc1ccc(COc2cccc(Br)c2)cn1.
What is the InChIKey of [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine?
The InChIKey is QYRJPXGCHGLGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrN3O/c13-10-2-1-3-11(6-10)17-8-9-4-5-12(16-14)15-7-9/h1-7H,8,14H2,(H,15,16).
What are the key properties of [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine?
[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine has a molecular weight of 294.15 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 62246032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).