[7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine

C10H6F5N3 — CID 62251548

IUPAC[7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine
SMILESNNc1cc(C(F)(F)F)nc2c(F)c(F)ccc12
InChIInChI=1S/C10H6F5N3/c11-5-2-1-4-6(18-16)3-7(10(13,14)15)17-9(4)8(5)12/h1-3H,16H2,(H,17,18)
InChIKeyVSPKAQWGVXBJNT-UHFFFAOYSA-N
MW263.17 g/mol
LogP2.82
Rot. Bonds1

About [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine

[7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine (PubChem CID 62251548) has the molecular formula C10H6F5N3 and a molecular weight of 263.17 g/mol. Its IUPAC name is [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine.

Molecular Properties

Compound Name[7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine
PubChem CID62251548
Molecular FormulaC10H6F5N3
Molecular Weight263.17 g/mol
Exact Mass263.05
IUPAC Name[7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine
SMILESNNc1cc(C(F)(F)F)nc2c(F)c(F)ccc12
InChIInChI=1S/C10H6F5N3/c11-5-2-1-4-6(18-16)3-7(10(13,14)15)17-9(4)8(5)12/h1-3H,16H2,(H,17,18)
InChIKeyVSPKAQWGVXBJNT-UHFFFAOYSA-N
XLogP2.82
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.17
LogP ≤ 52.82
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'}

Analyze [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
The IUPAC name of [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine (CID 62251548) is [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine.
What is the SMILES notation for [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
The canonical SMILES for [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine is NNc1cc(C(F)(F)F)nc2c(F)c(F)ccc12.
What is the InChIKey of [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
The InChIKey is VSPKAQWGVXBJNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F5N3/c11-5-2-1-4-6(18-16)3-7(10(13,14)15)17-9(4)8(5)12/h1-3H,16H2,(H,17,18).
What are the key properties of [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
[7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine has a molecular weight of 263.17 g/mol, XLogP of 2.82, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [7,8-difluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine is sourced from PubChem (CID 62251548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).