[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine

C8H9F4N3 — CID 105206013

IUPAC[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
SMILESNNC(CC(F)(F)F)c1ccncc1F
InChIInChI=1S/C8H9F4N3/c9-6-4-14-2-1-5(6)7(15-13)3-8(10,11)12/h1-2,4,7,15H,3,13H2
InChIKeyQLGAMGQHIFXUDT-UHFFFAOYSA-N
MW223.17 g/mol
LogP1.68
Rot. Bonds3

About [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine

[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine (PubChem CID 105206013) has the molecular formula C8H9F4N3 and a molecular weight of 223.17 g/mol. Its IUPAC name is [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine.

Molecular Properties

Compound Name[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
PubChem CID105206013
Molecular FormulaC8H9F4N3
Molecular Weight223.17 g/mol
Exact Mass223.07
IUPAC Name[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
SMILESNNC(CC(F)(F)F)c1ccncc1F
InChIInChI=1S/C8H9F4N3/c9-6-4-14-2-1-5(6)7(15-13)3-8(10,11)12/h1-2,4,7,15H,3,13H2
InChIKeyQLGAMGQHIFXUDT-UHFFFAOYSA-N
XLogP1.68
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.17
LogP ≤ 51.68
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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Frequently Asked Questions

What is the IUPAC name of [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine?
The IUPAC name of [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine (CID 105206013) is [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine.
What is the SMILES notation for [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine?
The canonical SMILES for [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine is NNC(CC(F)(F)F)c1ccncc1F.
What is the InChIKey of [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine?
The InChIKey is QLGAMGQHIFXUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F4N3/c9-6-4-14-2-1-5(6)7(15-13)3-8(10,11)12/h1-2,4,7,15H,3,13H2.
What are the key properties of [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine?
[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine has a molecular weight of 223.17 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine is sourced from PubChem (CID 105206013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).