[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine

C12H11Cl2N3O — CID 79233690

IUPAC[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine
SMILESNNc1cccc(COc2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C12H11Cl2N3O/c13-8-4-5-11(10(14)6-8)18-7-9-2-1-3-12(16-9)17-15/h1-6H,7,15H2,(H,16,17)
InChIKeyRFMFBHNXXYRBMB-UHFFFAOYSA-N
MW284.15 g/mol
LogP3.25
Rot. Bonds4

About [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine

[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine (PubChem CID 79233690) has the molecular formula C12H11Cl2N3O and a molecular weight of 284.15 g/mol. Its IUPAC name is [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine
PubChem CID79233690
Molecular FormulaC12H11Cl2N3O
Molecular Weight284.15 g/mol
Exact Mass283.03
IUPAC Name[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine
SMILESNNc1cccc(COc2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C12H11Cl2N3O/c13-8-4-5-11(10(14)6-8)18-7-9-2-1-3-12(16-9)17-15/h1-6H,7,15H2,(H,16,17)
InChIKeyRFMFBHNXXYRBMB-UHFFFAOYSA-N
XLogP3.25
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.15
LogP ≤ 53.25
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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Frequently Asked Questions

What is the IUPAC name of [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine (CID 79233690) is [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine is NNc1cccc(COc2ccc(Cl)cc2Cl)n1.
What is the InChIKey of [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine?
The InChIKey is RFMFBHNXXYRBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O/c13-8-4-5-11(10(14)6-8)18-7-9-2-1-3-12(16-9)17-15/h1-6H,7,15H2,(H,16,17).
What are the key properties of [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine?
[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine has a molecular weight of 284.15 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 79233690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).