[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine

C11H16Cl2N2O2S — CID 105302110

IUPAC[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
SMILESCC(C)(C(NN)c1cc(Cl)ccc1Cl)S(C)(=O)=O
InChIInChI=1S/C11H16Cl2N2O2S/c1-11(2,18(3,16)17)10(15-14)8-6-7(12)4-5-9(8)13/h4-6,10,15H,14H2,1-3H3
InChIKeyKCKRYHFLWKYKJL-UHFFFAOYSA-N
MW311.23 g/mol
LogP2.32
Rot. Bonds4

About [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine

[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine (PubChem CID 105302110) has the molecular formula C11H16Cl2N2O2S and a molecular weight of 311.23 g/mol. Its IUPAC name is [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
PubChem CID105302110
Molecular FormulaC11H16Cl2N2O2S
Molecular Weight311.23 g/mol
Exact Mass310.03
IUPAC Name[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
SMILESCC(C)(C(NN)c1cc(Cl)ccc1Cl)S(C)(=O)=O
InChIInChI=1S/C11H16Cl2N2O2S/c1-11(2,18(3,16)17)10(15-14)8-6-7(12)4-5-9(8)13/h4-6,10,15H,14H2,1-3H3
InChIKeyKCKRYHFLWKYKJL-UHFFFAOYSA-N
XLogP2.32
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.23
LogP ≤ 52.32
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-(4-bromo-3-chloro-2-fluorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 106765598
[2-methyl-2-methylsulfonyl-1-(4-propan-2-ylphenyl)propyl]hydrazine
CID 105304336
[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 105335480
[1-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 107292604
[1-(2-chloro-5-fluorophenyl)-2,2-dimethylpropyl]hydrazine
CID 105397762
1-(2-chloro-5-fluorophenyl)-2-methyl-2-methylsulfonylpropan-1-ol
CID 105397615
[(2,5-dichlorophenyl)-(3-methylsulfonylphenyl)methyl]hydrazine
CID 105301936
[1-(4-methoxy-2,5-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 105333051
[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 103436398
1-(2-chloro-4-fluoro-5-methylphenyl)-N-ethyl-2-methyl-2-methylsulfonylpropan-1-amine
CID 81045137
[(2,5-dichlorophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194107
(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine
CID 105312096

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The IUPAC name of [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine (CID 105302110) is [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine.
What is the SMILES notation for [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The canonical SMILES for [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine is CC(C)(C(NN)c1cc(Cl)ccc1Cl)S(C)(=O)=O.
What is the InChIKey of [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The InChIKey is KCKRYHFLWKYKJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Cl2N2O2S/c1-11(2,18(3,16)17)10(15-14)8-6-7(12)4-5-9(8)13/h4-6,10,15H,14H2,1-3H3.
What are the key properties of [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine has a molecular weight of 311.23 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine is sourced from PubChem (CID 105302110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).