[1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine

C11H15F3N2O — CID 105207214

IUPAC[1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
SMILESCOCC(Cc1cccc(C(F)(F)F)c1)NN
InChIInChI=1S/C11H15F3N2O/c1-17-7-10(16-15)6-8-3-2-4-9(5-8)11(12,13)14/h2-5,10,16H,6-7,15H2,1H3
InChIKeyJLGISCCNOKBETK-UHFFFAOYSA-N
MW248.25 g/mol
LogP1.73
Rot. Bonds5

About [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine

[1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine (PubChem CID 105207214) has the molecular formula C11H15F3N2O and a molecular weight of 248.25 g/mol. Its IUPAC name is [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
PubChem CID105207214
Molecular FormulaC11H15F3N2O
Molecular Weight248.25 g/mol
Exact Mass248.11
IUPAC Name[1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
SMILESCOCC(Cc1cccc(C(F)(F)F)c1)NN
InChIInChI=1S/C11H15F3N2O/c1-17-7-10(16-15)6-8-3-2-4-9(5-8)11(12,13)14/h2-5,10,16H,6-7,15H2,1H3
InChIKeyJLGISCCNOKBETK-UHFFFAOYSA-N
XLogP1.73
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 51.73
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-(2-methoxyethoxy)-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 114033159
N-ethyl-1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-amine
CID 62603541
1-methoxy-N-propyl-3-[3-(trifluoromethyl)phenyl]propan-2-amine
CID 62605208
[4-(2,2-difluoroethoxy)-1-[3-(trifluoromethyl)phenyl]butan-2-yl]hydrazine
CID 103151932
[1-(furan-2-yl)-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 105235150
[1-(1-methylcyclopropyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105253379
[3,4-dimethyl-1-[3-(trifluoromethyl)phenyl]pentan-2-yl]hydrazine
CID 105293250
[1-(4-tert-butylphenyl)-3-methoxypropan-2-yl]hydrazine
CID 105207262
5-methoxy-N-methyl-1-[3-(trifluoromethyl)phenyl]hexan-2-amine
CID 105123547
[(2R)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]azanium
CID 38988975
[1-(1-methoxycyclopentyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105268693
[1-cyclopentylsulfanyl-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 105227477

Frequently Asked Questions

What is the IUPAC name of [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine?
The IUPAC name of [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine (CID 105207214) is [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine.
What is the SMILES notation for [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine?
The canonical SMILES for [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine is COCC(Cc1cccc(C(F)(F)F)c1)NN.
What is the InChIKey of [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine?
The InChIKey is JLGISCCNOKBETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O/c1-17-7-10(16-15)6-8-3-2-4-9(5-8)11(12,13)14/h2-5,10,16H,6-7,15H2,1H3.
What are the key properties of [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine?
[1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine has a molecular weight of 248.25 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-methoxy-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine is sourced from PubChem (CID 105207214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).