[1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine

C10H14Cl2N2O2S — CID 105281333

IUPAC[1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine
SMILESCC(C(NN)c1ccc(Cl)c(Cl)c1)S(C)(=O)=O
InChIInChI=1S/C10H14Cl2N2O2S/c1-6(17(2,15)16)10(14-13)7-3-4-8(11)9(12)5-7/h3-6,10,14H,13H2,1-2H3
InChIKeyOVOTTZSHCWHGIQ-UHFFFAOYSA-N
MW297.21 g/mol
LogP1.93
Rot. Bonds4

About [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine

[1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine (PubChem CID 105281333) has the molecular formula C10H14Cl2N2O2S and a molecular weight of 297.21 g/mol. Its IUPAC name is [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine
PubChem CID105281333
Molecular FormulaC10H14Cl2N2O2S
Molecular Weight297.21 g/mol
Exact Mass296.02
IUPAC Name[1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine
SMILESCC(C(NN)c1ccc(Cl)c(Cl)c1)S(C)(=O)=O
InChIInChI=1S/C10H14Cl2N2O2S/c1-6(17(2,15)16)10(14-13)7-3-4-8(11)9(12)5-7/h3-6,10,14H,13H2,1-2H3
InChIKeyOVOTTZSHCWHGIQ-UHFFFAOYSA-N
XLogP1.93
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.21
LogP ≤ 51.93
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

[1-(3-chlorophenyl)-2-methylsulfonylpropyl]hydrazine
CID 105289216
1-amino-2-(3,4-dichlorophenyl)-4-methylsulfonylpentan-3-ol
CID 104522693
[2-methylsulfonyl-1-(4-propylphenyl)propyl]hydrazine
CID 105303830
[1-(3,5-dimethoxyphenyl)-2-methylsulfonylpropyl]hydrazine
CID 105323905
[(3,4-dichlorophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194109
1,2-dichloro-4-[1-(sulfamoylamino)ethyl]benzene
CID 112684116
[1-(2,5-dichlorophenyl)-3-methylsulfonylbutan-2-yl]hydrazine
CID 105309866
[1-(3,4-dichlorophenyl)-2-ethoxybutyl]hydrazine
CID 105271084
1-(3,4-dichlorophenyl)-N,2-dimethylpropane-1,3-diamine
CID 116948774
methyl 2-(3,4-dichlorophenyl)propanoate
CID 11402033
[(3-chloro-4-iodophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
CID 103217225
4-[(2R)-butan-2-yl]-1,2-dichlorobenzene
CID 118120399

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine?
The IUPAC name of [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine (CID 105281333) is [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine.
What is the SMILES notation for [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine?
The canonical SMILES for [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine is CC(C(NN)c1ccc(Cl)c(Cl)c1)S(C)(=O)=O.
What is the InChIKey of [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine?
The InChIKey is OVOTTZSHCWHGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2O2S/c1-6(17(2,15)16)10(14-13)7-3-4-8(11)9(12)5-7/h3-6,10,14H,13H2,1-2H3.
What are the key properties of [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine?
[1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine has a molecular weight of 297.21 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dichlorophenyl)-2-methylsulfonylpropyl]hydrazine is sourced from PubChem (CID 105281333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).