[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine

C12H15F5N2O — CID 103477642

IUPAC[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
SMILESNNC(COCC(F)(F)C(F)F)Cc1ccccc1F
InChIInChI=1S/C12H15F5N2O/c13-10-4-2-1-3-8(10)5-9(19-18)6-20-7-12(16,17)11(14)15/h1-4,9,11,19H,5-7,18H2
InChIKeyUSHWQCNMFSNQFF-UHFFFAOYSA-N
MW298.25 g/mol
LogP2.12
Rot. Bonds8

About [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine

[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine (PubChem CID 103477642) has the molecular formula C12H15F5N2O and a molecular weight of 298.25 g/mol. Its IUPAC name is [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
PubChem CID103477642
Molecular FormulaC12H15F5N2O
Molecular Weight298.25 g/mol
Exact Mass298.11
IUPAC Name[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
SMILESNNC(COCC(F)(F)C(F)F)Cc1ccccc1F
InChIInChI=1S/C12H15F5N2O/c13-10-4-2-1-3-8(10)5-9(19-18)6-20-7-12(16,17)11(14)15/h1-4,9,11,19H,5-7,18H2
InChIKeyUSHWQCNMFSNQFF-UHFFFAOYSA-N
XLogP2.12
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.25
LogP ≤ 52.12
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'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

[1-(2-chloro-6-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477829
[1-(2-bromo-4-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477734
[1-(3-bromothiophen-2-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477808
[1-(2,2,3,3-tetrafluoropropoxy)-3-thiophen-3-ylpropan-2-yl]hydrazine
CID 103477736
[1-(3-bromo-5-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477886
[1-(4-chlorophenyl)-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105197647
[1-phenyl-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
CID 103217246
1-(2,2,3,3-tetrafluoropropoxy)pent-4-yn-2-ylhydrazine
CID 103477640
[1-(2-fluorophenyl)-3-(furan-2-yl)propan-2-yl]hydrazine
CID 105206963
[1-chloro-1,1-difluoro-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105265444
1-(2-fluorophenyl)hexan-2-ylhydrazine
CID 105206821
[1-(5-bromothiophen-2-yl)-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105206828

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
The IUPAC name of [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine (CID 103477642) is [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine is NNC(COCC(F)(F)C(F)F)Cc1ccccc1F.
What is the InChIKey of [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
The InChIKey is USHWQCNMFSNQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F5N2O/c13-10-4-2-1-3-8(10)5-9(19-18)6-20-7-12(16,17)11(14)15/h1-4,9,11,19H,5-7,18H2.
What are the key properties of [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine?
[1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine has a molecular weight of 298.25 g/mol, XLogP of 2.12, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine is sourced from PubChem (CID 103477642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).