[3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine

C12H12BrN3O — CID 82056386

IUPAC[3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine
SMILESNNc1ncccc1OCc1ccc(Br)cc1
InChIInChI=1S/C12H12BrN3O/c13-10-5-3-9(4-6-10)8-17-11-2-1-7-15-12(11)16-14/h1-7H,8,14H2,(H,15,16)
InChIKeyBWSSEACUVWCTGD-UHFFFAOYSA-N
MW294.15 g/mol
LogP2.71
Rot. Bonds4

About [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine

[3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine (PubChem CID 82056386) has the molecular formula C12H12BrN3O and a molecular weight of 294.15 g/mol. Its IUPAC name is [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine
PubChem CID82056386
Molecular FormulaC12H12BrN3O
Molecular Weight294.15 g/mol
Exact Mass293.02
IUPAC Name[3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine
SMILESNNc1ncccc1OCc1ccc(Br)cc1
InChIInChI=1S/C12H12BrN3O/c13-10-5-3-9(4-6-10)8-17-11-2-1-7-15-12(11)16-14/h1-7H,8,14H2,(H,15,16)
InChIKeyBWSSEACUVWCTGD-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

[3-[(4-bromophenyl)methoxy]-2-pyridinyl]methanamine
CID 82828357
[3-[(5-bromo-2-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 107285501
(3-pentoxy-2-pyridinyl)hydrazine
CID 55281396
N-[(4-bromophenyl)methyl]-3-methoxypyridin-2-amine
CID 112547909
2-[(2-hydrazinyl-3-pyridinyl)oxy]-N,N-dimethylethanamine
CID 55281550
(3-methyl-4-phenylmethoxy-2-pyridinyl)hydrazine
CID 70451114
[3-(4-phenoxybutoxy)-2-pyridinyl]hydrazine
CID 82056411
1-[2-[(4-bromophenyl)methoxy]phenyl]ethanamine
CID 60879192
[6-[(4-bromophenyl)methoxy]-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 82825311
1-bromo-4-[[2-(bromomethyl)phenoxy]methyl]benzene
CID 43141593
N-[(4-bromophenyl)methyl]-2-hydrazinyl-N-methylpyridine-3-carboxamide
CID 62243531
4-[(2-bromo-3-pyridinyl)oxymethyl]benzonitrile
CID 47808098

Frequently Asked Questions

What is the IUPAC name of [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine?
The IUPAC name of [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine (CID 82056386) is [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine.
What is the SMILES notation for [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine?
The canonical SMILES for [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine is NNc1ncccc1OCc1ccc(Br)cc1.
What is the InChIKey of [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine?
The InChIKey is BWSSEACUVWCTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrN3O/c13-10-5-3-9(4-6-10)8-17-11-2-1-7-15-12(11)16-14/h1-7H,8,14H2,(H,15,16).
What are the key properties of [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine?
[3-[(4-bromophenyl)methoxy]-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 [3-[(4-bromophenyl)methoxy]-2-pyridinyl]hydrazine is sourced from PubChem (CID 82056386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).