[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine

C12H19FN2O — CID 105245348

IUPAC[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
SMILESCOC(C)(C)C(Cc1ccccc1F)NN
InChIInChI=1S/C12H19FN2O/c1-12(2,16-3)11(15-14)8-9-6-4-5-7-10(9)13/h4-7,11,15H,8,14H2,1-3H3
InChIKeyINPSOFKTSBZFFD-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.63
Rot. Bonds5

About [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine

[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine (PubChem CID 105245348) has the molecular formula C12H19FN2O and a molecular weight of 226.30 g/mol. Its IUPAC name is [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
PubChem CID105245348
Molecular FormulaC12H19FN2O
Molecular Weight226.30 g/mol
Exact Mass226.15
IUPAC Name[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
SMILESCOC(C)(C)C(Cc1ccccc1F)NN
InChIInChI=1S/C12H19FN2O/c1-12(2,16-3)11(15-14)8-9-6-4-5-7-10(9)13/h4-7,11,15H,8,14H2,1-3H3
InChIKeyINPSOFKTSBZFFD-UHFFFAOYSA-N
XLogP1.63
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.63
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

[1-(4-chloro-2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 105245389
[1-(5-bromo-2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 105245363
[1-chloro-1,1-difluoro-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105265444
1-(5-chloro-2-fluorophenyl)-3-methoxy-N,3-dimethylbutan-2-amine
CID 103048890
1-(3-chloro-2-fluorophenyl)-3-methoxy-N,3-dimethylbutan-2-amine
CID 102857757
[1-(3-fluoro-4-methoxyphenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 105245358
[1-(3-bromo-2,6-difluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 106271060
[1-(2-chloro-4-methylphenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 106868583
[3-ethoxy-1-(2-fluorophenyl)-4,4-dimethylpentan-2-yl]hydrazine
CID 105273741
N-[1-(2-fluorophenyl)propan-2-yl]-2-methoxy-2-methylpropan-1-amine
CID 114830797
[3-methoxy-3-methyl-1-(3-methylphenyl)butan-2-yl]hydrazine
CID 105245324
[1-(2-bromophenyl)-3-ethoxy-3-methylbutan-2-yl]hydrazine
CID 105274246

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
The IUPAC name of [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine (CID 105245348) is [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
The canonical SMILES for [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine is COC(C)(C)C(Cc1ccccc1F)NN.
What is the InChIKey of [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
The InChIKey is INPSOFKTSBZFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FN2O/c1-12(2,16-3)11(15-14)8-9-6-4-5-7-10(9)13/h4-7,11,15H,8,14H2,1-3H3.
What are the key properties of [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine?
[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine has a molecular weight of 226.30 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine is sourced from PubChem (CID 105245348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).