[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine

C14H24N2O3S — CID 103436398

IUPAC[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
SMILESCOc1c(C(NN)C(C)(C)S(C)(=O)=O)ccc(C)c1C
InChIInChI=1S/C14H24N2O3S/c1-9-7-8-11(12(19-5)10(9)2)13(16-15)14(3,4)20(6,17)18/h7-8,13,16H,15H2,1-6H3
InChIKeyJYKVNNRPCRPELP-UHFFFAOYSA-N
MW300.42 g/mol
LogP1.64
Rot. Bonds5

About [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine

[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine (PubChem CID 103436398) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
PubChem CID103436398
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC Name[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
SMILESCOc1c(C(NN)C(C)(C)S(C)(=O)=O)ccc(C)c1C
InChIInChI=1S/C14H24N2O3S/c1-9-7-8-11(12(19-5)10(9)2)13(16-15)14(3,4)20(6,17)18/h7-8,13,16H,15H2,1-6H3
InChIKeyJYKVNNRPCRPELP-UHFFFAOYSA-N
XLogP1.64
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-methylbutyl]hydrazine
CID 103436158
[1-(4-methoxy-2,5-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 105333051
[(2-bromo-4-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 103436225
[(2-fluoro-3-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 103436271
[(2-bromo-3-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 107986232
[(3,4-dimethylphenyl)-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 103436388
[(3-bromo-2-chlorophenyl)-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 103436318
2-ethoxy-N-ethyl-1-(2-methoxy-3,4-dimethylphenyl)-2-methylbutan-1-amine
CID 103433948
1-(2-methoxy-3,4-dimethylphenyl)-2,2-dimethylpropan-1-ol
CID 103432558
3-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-3-methylbutan-1-amine
CID 103435571
[1-(4-bromo-3-chloro-2-fluorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 106765598
2-ethyl-2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-N-methylbutan-1-amine
CID 103433952

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The IUPAC name of [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine (CID 103436398) is [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine.
What is the SMILES notation for [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The canonical SMILES for [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine is COc1c(C(NN)C(C)(C)S(C)(=O)=O)ccc(C)c1C.
What is the InChIKey of [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The InChIKey is JYKVNNRPCRPELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S/c1-9-7-8-11(12(19-5)10(9)2)13(16-15)14(3,4)20(6,17)18/h7-8,13,16H,15H2,1-6H3.
What are the key properties of [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
[1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine has a molecular weight of 300.42 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxy-3,4-dimethylphenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine is sourced from PubChem (CID 103436398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).