[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine

C9H5Cl2F3N4 — CID 3410226

IUPAC[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine
SMILESNNc1nc2cc(Cl)c(Cl)cc2nc1C(F)(F)F
InChIInChI=1S/C9H5Cl2F3N4/c10-3-1-5-6(2-4(3)11)17-8(18-15)7(16-5)9(12,13)14/h1-2H,15H2,(H,17,18)
InChIKeyCIJPLIXNNSXNQE-UHFFFAOYSA-N
MW297.07 g/mol
LogP3.24
Rot. Bonds1

About [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine

[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine (PubChem CID 3410226) has the molecular formula C9H5Cl2F3N4 and a molecular weight of 297.07 g/mol. Its IUPAC name is [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine.

Molecular Properties

Compound Name[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine
PubChem CID3410226
Molecular FormulaC9H5Cl2F3N4
Molecular Weight297.07 g/mol
Exact Mass295.98
IUPAC Name[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine
SMILESNNc1nc2cc(Cl)c(Cl)cc2nc1C(F)(F)F
InChIInChI=1S/C9H5Cl2F3N4/c10-3-1-5-6(2-4(3)11)17-8(18-15)7(16-5)9(12,13)14/h1-2H,15H2,(H,17,18)
InChIKeyCIJPLIXNNSXNQE-UHFFFAOYSA-N
XLogP3.24
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.07
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-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 [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine?
The IUPAC name of [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine (CID 3410226) is [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine.
What is the SMILES notation for [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine?
The canonical SMILES for [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine is NNc1nc2cc(Cl)c(Cl)cc2nc1C(F)(F)F.
What is the InChIKey of [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine?
The InChIKey is CIJPLIXNNSXNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5Cl2F3N4/c10-3-1-5-6(2-4(3)11)17-8(18-15)7(16-5)9(12,13)14/h1-2H,15H2,(H,17,18).
What are the key properties of [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine?
[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine has a molecular weight of 297.07 g/mol, XLogP of 3.24, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine is sourced from PubChem (CID 3410226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).