[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine

C12H11Cl2N3O3S — CID 102762928

IUPAC[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine
SMILESCS(=O)(=O)c1ccc(Oc2nc(NN)c(Cl)cc2Cl)cc1
InChIInChI=1S/C12H11Cl2N3O3S/c1-21(18,19)8-4-2-7(3-5-8)20-12-10(14)6-9(13)11(16-12)17-15/h2-6H,15H2,1H3,(H,16,17)
InChIKeyZJXJBHHUKZEDBC-UHFFFAOYSA-N
MW348.21 g/mol
LogP2.87
Rot. Bonds4

About [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine

[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine (PubChem CID 102762928) has the molecular formula C12H11Cl2N3O3S and a molecular weight of 348.21 g/mol. Its IUPAC name is [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine
PubChem CID102762928
Molecular FormulaC12H11Cl2N3O3S
Molecular Weight348.21 g/mol
Exact Mass346.99
IUPAC Name[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine
SMILESCS(=O)(=O)c1ccc(Oc2nc(NN)c(Cl)cc2Cl)cc1
InChIInChI=1S/C12H11Cl2N3O3S/c1-21(18,19)8-4-2-7(3-5-8)20-12-10(14)6-9(13)11(16-12)17-15/h2-6H,15H2,1H3,(H,16,17)
InChIKeyZJXJBHHUKZEDBC-UHFFFAOYSA-N
XLogP2.87
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.21
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)oxy]benzamide
CID 102762897
5-chloro-4-(4-methylsulfonylphenoxy)pyrimidin-2-amine
CID 80874158
2-[4-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107710331
[3,5-dichloro-6-(2,4-dimethylphenoxy)-2-pyridinyl]hydrazine
CID 102762815
3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine
CID 102760799
[3,5-dichloro-6-(2-methyl-5-nitrophenoxy)-2-pyridinyl]hydrazine
CID 102762949
3,5,6-trichloro-N-(4-methylsulfonylphenyl)pyridin-2-amine
CID 102750033
6-chloro-2-(4-methylsulfonylphenoxy)pyridine-3-carboxylic acid
CID 63376748
[4,6-dimethyl-2-(4-methylsulfonylphenoxy)-3-pyridinyl]methanamine
CID 61175958
2-chloro-4-(4-methylsulfonylphenoxy)pyrimidine
CID 53486073
[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine
CID 106598864
[3-chloro-4-(4-methylsulfonylphenoxy)phenyl]methanamine
CID 63086683

Frequently Asked Questions

What is the IUPAC name of [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine?
The IUPAC name of [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine (CID 102762928) is [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine.
What is the SMILES notation for [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine?
The canonical SMILES for [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine is CS(=O)(=O)c1ccc(Oc2nc(NN)c(Cl)cc2Cl)cc1.
What is the InChIKey of [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine?
The InChIKey is ZJXJBHHUKZEDBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O3S/c1-21(18,19)8-4-2-7(3-5-8)20-12-10(14)6-9(13)11(16-12)17-15/h2-6H,15H2,1H3,(H,16,17).
What are the key properties of [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine?
[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine has a molecular weight of 348.21 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine is sourced from PubChem (CID 102762928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).