[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine

C11H15F3N2O — CID 103217246

IUPAC[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
SMILESNNC(COCC(F)(F)F)Cc1ccccc1
InChIInChI=1S/C11H15F3N2O/c12-11(13,14)8-17-7-10(16-15)6-9-4-2-1-3-5-9/h1-5,10,16H,6-8,15H2
InChIKeyZHXFDPBBJXNDIA-UHFFFAOYSA-N
MW248.25 g/mol
LogP1.64
Rot. Bonds6

About [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine

[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine (PubChem CID 103217246) has the molecular formula C11H15F3N2O and a molecular weight of 248.25 g/mol. Its IUPAC name is [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
PubChem CID103217246
Molecular FormulaC11H15F3N2O
Molecular Weight248.25 g/mol
Exact Mass248.11
IUPAC Name[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
SMILESNNC(COCC(F)(F)F)Cc1ccccc1
InChIInChI=1S/C11H15F3N2O/c12-11(13,14)8-17-7-10(16-15)6-9-4-2-1-3-5-9/h1-5,10,16H,6-8,15H2
InChIKeyZHXFDPBBJXNDIA-UHFFFAOYSA-N
XLogP1.64
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 51.64
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-tert-butylphenyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
CID 103217379
1-phenyl-N-propyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103214527
[1-phenyl-3-[4-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 105195282
2-benzyl-N-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 106705871
[1-(5-ethyl-2-pyridinyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
CID 103217657
[1-(4-fluoro-2-methylphenyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
CID 103217827
N-(1-amino-3-phenylpropan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 103212909
[1-methoxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
CID 103217630
[1-(2-methoxyethoxy)-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 114033159
2-benzyl-N-propyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 106705873
[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477642
1-phenyl-N-(2,2,2-trifluoroethoxy)butan-2-amine
CID 82711434

Frequently Asked Questions

What is the IUPAC name of [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
The IUPAC name of [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine (CID 103217246) is [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine.
What is the SMILES notation for [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
The canonical SMILES for [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine is NNC(COCC(F)(F)F)Cc1ccccc1.
What is the InChIKey of [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
The InChIKey is ZHXFDPBBJXNDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O/c12-11(13,14)8-17-7-10(16-15)6-9-4-2-1-3-5-9/h1-5,10,16H,6-8,15H2.
What are the key properties of [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine has a molecular weight of 248.25 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine is sourced from PubChem (CID 103217246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).