[1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine

C13H21FN2O2 — CID 103025453

IUPAC[1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine
SMILESCOc1ccc(F)cc1C(CC(C)(C)OC)NN
InChIInChI=1S/C13H21FN2O2/c1-13(2,18-4)8-11(16-15)10-7-9(14)5-6-12(10)17-3/h5-7,11,16H,8,15H2,1-4H3
InChIKeyGULHAEMEKQSHBW-UHFFFAOYSA-N
MW256.32 g/mol
LogP2.15
Rot. Bonds6

About [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine

[1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine (PubChem CID 103025453) has the molecular formula C13H21FN2O2 and a molecular weight of 256.32 g/mol. Its IUPAC name is [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine
PubChem CID103025453
Molecular FormulaC13H21FN2O2
Molecular Weight256.32 g/mol
Exact Mass256.16
IUPAC Name[1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine
SMILESCOc1ccc(F)cc1C(CC(C)(C)OC)NN
InChIInChI=1S/C13H21FN2O2/c1-13(2,18-4)8-11(16-15)10-7-9(14)5-6-12(10)17-3/h5-7,11,16H,8,15H2,1-4H3
InChIKeyGULHAEMEKQSHBW-UHFFFAOYSA-N
XLogP2.15
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 52.15
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-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutan-1-ol
CID 103027670
[1-(5-fluoro-2-methoxyphenyl)-2-propan-2-yloxyethyl]hydrazine
CID 105330779
1-(5-fluoro-2-methoxyphenyl)-3,3-dimethylbutan-1-amine
CID 43122340
[1-(5-fluoro-2-methoxyphenyl)-2,2-dimethylbutyl]hydrazine
CID 105330933
[2-(4-bromophenyl)-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105195600
[2-cyclohexyl-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105330836
[1-(2-methoxy-5-methylphenyl)-3,3-dimethylbutyl]hydrazine
CID 105220303
[1-(3,5-difluorophenyl)-3-methoxy-3-methylbutyl]hydrazine
CID 103025282
[1-(5-fluoro-2-methylphenyl)-4-methoxy-4-methylpentyl]hydrazine
CID 103026629
1-(5-fluoro-2-methoxyphenyl)-N,3,5,5-tetramethylhexan-1-amine
CID 43485634
[2-cyclopentylsulfanyl-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105227559
[2-(cyclohexen-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105270064

Frequently Asked Questions

What is the IUPAC name of [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine?
The IUPAC name of [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine (CID 103025453) is [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine is COc1ccc(F)cc1C(CC(C)(C)OC)NN.
What is the InChIKey of [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine?
The InChIKey is GULHAEMEKQSHBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21FN2O2/c1-13(2,18-4)8-11(16-15)10-7-9(14)5-6-12(10)17-3/h5-7,11,16H,8,15H2,1-4H3.
What are the key properties of [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine?
[1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine has a molecular weight of 256.32 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutyl]hydrazine is sourced from PubChem (CID 103025453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).