[1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine

C13H22N2O — CID 105270775

IUPAC[1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine
SMILESCCC(OC)C(NN)c1ccc(C)c(C)c1
InChIInChI=1S/C13H22N2O/c1-5-12(16-4)13(15-14)11-7-6-9(2)10(3)8-11/h6-8,12-13,15H,5,14H2,1-4H3
InChIKeyFRNKNQPTUNUFLU-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.23
Rot. Bonds5

About [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine

[1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine (PubChem CID 105270775) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine
PubChem CID105270775
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name[1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine
SMILESCCC(OC)C(NN)c1ccc(C)c(C)c1
InChIInChI=1S/C13H22N2O/c1-5-12(16-4)13(15-14)11-7-6-9(2)10(3)8-11/h6-8,12-13,15H,5,14H2,1-4H3
InChIKeyFRNKNQPTUNUFLU-UHFFFAOYSA-N
XLogP2.23
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(4-phenylphenyl)butyl]hydrazine
CID 105270591
[1-(3,4-dimethoxyphenyl)-2-methoxypentyl]hydrazine
CID 105271639
[1-(3,4-dimethylphenyl)-2-phenylbutyl]hydrazine
CID 105300257
[1-(2,6-difluoro-3-methylphenyl)-2-methoxybutyl]hydrazine
CID 105270622
4-(1-methoxypropyl)-1,2-dimethylbenzene
CID 54163976
[2-methoxy-1-(5-methylthiophen-2-yl)butyl]hydrazine
CID 105270643
bis(3,4-dimethylphenyl)methylhydrazine
CID 105300164
[2-methoxy-1-(2-methylthiophen-3-yl)butyl]hydrazine
CID 102843058
[2-methoxy-1-(1-methylpyrazol-4-yl)butyl]hydrazine
CID 105270600
1-(3,4-dimethylphenyl)-2-methoxy-3-methyl-N-propylbutan-1-amine
CID 116720687
[1-(3,4-dichlorophenyl)-2-ethoxybutyl]hydrazine
CID 105271084
(1R)-1-(3,4-dimethylphenyl)-2-methylbutan-1-amine
CID 131078048

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine?
The IUPAC name of [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine (CID 105270775) is [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine.
What is the SMILES notation for [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine?
The canonical SMILES for [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine is CCC(OC)C(NN)c1ccc(C)c(C)c1.
What is the InChIKey of [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine?
The InChIKey is FRNKNQPTUNUFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-5-12(16-4)13(15-14)11-7-6-9(2)10(3)8-11/h6-8,12-13,15H,5,14H2,1-4H3.
What are the key properties of [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine?
[1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine has a molecular weight of 222.33 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethylphenyl)-2-methoxybutyl]hydrazine is sourced from PubChem (CID 105270775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).