[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine

C14H14Cl2N2O2S — CID 105301936

IUPAC[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine
SMILESCS(=O)(=O)c1cccc(C(NN)c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C14H14Cl2N2O2S/c1-21(19,20)11-4-2-3-9(7-11)14(18-17)12-8-10(15)5-6-13(12)16/h2-8,14,18H,17H2,1H3
InChIKeyQEHBIJXGRYOHPK-UHFFFAOYSA-N
MW345.25 g/mol
LogP2.95
Rot. Bonds4

About [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine

[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine (PubChem CID 105301936) has the molecular formula C14H14Cl2N2O2S and a molecular weight of 345.25 g/mol. Its IUPAC name is [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine
PubChem CID105301936
Molecular FormulaC14H14Cl2N2O2S
Molecular Weight345.25 g/mol
Exact Mass344.02
IUPAC Name[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine
SMILESCS(=O)(=O)c1cccc(C(NN)c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C14H14Cl2N2O2S/c1-21(19,20)11-4-2-3-9(7-11)14(18-17)12-8-10(15)5-6-13(12)16/h2-8,14,18H,17H2,1H3
InChIKeyQEHBIJXGRYOHPK-UHFFFAOYSA-N
XLogP2.95
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.25
LogP ≤ 52.95
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

(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methanol
CID 61082000
[(5-fluoro-2-methylphenyl)-(3-methylsulfonylphenyl)methyl]hydrazine
CID 105302119
[(4-fluoro-2-methylphenyl)-(3-methylsulfonylphenyl)methyl]hydrazine
CID 105302391
[(2,5-dichlorophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194107
[furan-2-yl-(3-methylsulfonylphenyl)methyl]hydrazine
CID 105305957
(3-chlorophenyl)-(3-methylsulfonylphenyl)methanamine
CID 115811597
[(5-chloro-2-fluorophenyl)-(3-chlorophenyl)methyl]hydrazine
CID 105280223
(2-chloro-4,5-difluorophenyl)-(3-methylsulfonylphenyl)methanamine
CID 107475895
(4-chlorophenyl)-(3-methylsulfonylphenyl)methanol
CID 61101064
3-amino-N-[(4-ethylphenyl)-(3-methylsulfonylphenyl)methyl]propanamide
CID 119331161
1-(4-fluoro-2-methylphenyl)-N-methyl-1-(3-methylsulfonylphenyl)methanamine
CID 115852484
[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine
CID 105282883

Frequently Asked Questions

What is the IUPAC name of [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine?
The IUPAC name of [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine (CID 105301936) is [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine is CS(=O)(=O)c1cccc(C(NN)c2cc(Cl)ccc2Cl)c1.
What is the InChIKey of [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine?
The InChIKey is QEHBIJXGRYOHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O2S/c1-21(19,20)11-4-2-3-9(7-11)14(18-17)12-8-10(15)5-6-13(12)16/h2-8,14,18H,17H2,1H3.
What are the key properties of [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine?
[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine has a molecular weight of 345.25 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine is sourced from PubChem (CID 105301936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).