(4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine

C7H8F3N3O — CID 729329

IUPAC(4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine
SMILESCCOc1c(F)c(F)nc(NN)c1F
InChIInChI=1S/C7H8F3N3O/c1-2-14-5-3(8)6(10)12-7(13-11)4(5)9/h2,11H2,1H3,(H,12,13)
InChIKeyHOQNIJUTZWFBNI-UHFFFAOYSA-N
MW207.15 g/mol
LogP1.18
Rot. Bonds3

About (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine

(4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine (PubChem CID 729329) has the molecular formula C7H8F3N3O and a molecular weight of 207.15 g/mol. Its IUPAC name is (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine.

Molecular Properties

Compound Name(4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine
PubChem CID729329
Molecular FormulaC7H8F3N3O
Molecular Weight207.15 g/mol
Exact Mass207.06
IUPAC Name(4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine
SMILESCCOc1c(F)c(F)nc(NN)c1F
InChIInChI=1S/C7H8F3N3O/c1-2-14-5-3(8)6(10)12-7(13-11)4(5)9/h2,11H2,1H3,(H,12,13)
InChIKeyHOQNIJUTZWFBNI-UHFFFAOYSA-N
XLogP1.18
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.15
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'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 (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine?
The IUPAC name of (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine (CID 729329) is (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine.
What is the SMILES notation for (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine?
The canonical SMILES for (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine is CCOc1c(F)c(F)nc(NN)c1F.
What is the InChIKey of (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine?
The InChIKey is HOQNIJUTZWFBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3O/c1-2-14-5-3(8)6(10)12-7(13-11)4(5)9/h2,11H2,1H3,(H,12,13).
What are the key properties of (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine?
(4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine has a molecular weight of 207.15 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxy-3,5,6-trifluoro-2-pyridinyl)hydrazine is sourced from PubChem (CID 729329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).