[6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine

C13H13BrClN3O2 — CID 83140587

IUPAC[6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine
SMILESCOc1cccc(Br)c1OCc1nc(NN)ccc1Cl
InChIInChI=1S/C13H13BrClN3O2/c1-19-11-4-2-3-8(14)13(11)20-7-10-9(15)5-6-12(17-10)18-16/h2-6H,7,16H2,1H3,(H,17,18)
InChIKeyNLVSCBWCGNHYPH-UHFFFAOYSA-N
MW358.62 g/mol
LogP3.37
Rot. Bonds5

About [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine

[6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine (PubChem CID 83140587) has the molecular formula C13H13BrClN3O2 and a molecular weight of 358.62 g/mol. Its IUPAC name is [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine
PubChem CID83140587
Molecular FormulaC13H13BrClN3O2
Molecular Weight358.62 g/mol
Exact Mass356.99
IUPAC Name[6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine
SMILESCOc1cccc(Br)c1OCc1nc(NN)ccc1Cl
InChIInChI=1S/C13H13BrClN3O2/c1-19-11-4-2-3-8(14)13(11)20-7-10-9(15)5-6-12(17-10)18-16/h2-6H,7,16H2,1H3,(H,17,18)
InChIKeyNLVSCBWCGNHYPH-UHFFFAOYSA-N
XLogP3.37
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.62
LogP ≤ 53.37
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'}

Analyze [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-chloro-6-[(2,6-dibromophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62887202
5-chloro-6-[(2,6-dibromophenoxy)methyl]-N-ethylpyridin-2-amine
CID 63485313
[5-chloro-6-(methoxymethyl)-2-pyridinyl]hydrazine
CID 62884913
2-[(2-bromo-6-methoxyphenoxy)methyl]-4-chloro-6-methylpyrimidine
CID 83140307
[6-[(2-butan-2-ylphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine
CID 62887389
2-[2-[(3-chloro-6-hydrazinyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 107714116
6-[(2-bromo-6-methoxyphenoxy)methyl]pyridin-2-amine
CID 83140412
6-[(2-bromo-6-methoxyphenoxy)methyl]pyridine-3-carbohydrazide
CID 83137072
[6-[(4-butylphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine
CID 115493212
[5-chloro-6-(pentoxymethyl)-2-pyridinyl]hydrazine
CID 62887028
5-chloro-6-[(4-methoxyphenoxy)methyl]-N-methylpyridin-2-amine
CID 62885465
5-[(2-bromo-6-methoxyphenoxy)methyl]-2-methoxyaniline
CID 83141041

Frequently Asked Questions

What is the IUPAC name of [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine?
The IUPAC name of [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine (CID 83140587) is [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine?
The canonical SMILES for [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine is COc1cccc(Br)c1OCc1nc(NN)ccc1Cl.
What is the InChIKey of [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine?
The InChIKey is NLVSCBWCGNHYPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13BrClN3O2/c1-19-11-4-2-3-8(14)13(11)20-7-10-9(15)5-6-12(17-10)18-16/h2-6H,7,16H2,1H3,(H,17,18).
What are the key properties of [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine?
[6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine has a molecular weight of 358.62 g/mol, XLogP of 3.37, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2-bromo-6-methoxyphenoxy)methyl]-5-chloro-2-pyridinyl]hydrazine is sourced from PubChem (CID 83140587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).