[7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine

C10H6ClF4N3 — CID 62250575

IUPAC[7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine
SMILESNNc1cc(C(F)(F)F)nc2c(F)c(Cl)ccc12
InChIInChI=1S/C10H6ClF4N3/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)
InChIKeyNIXSGJRBXMFGKN-UHFFFAOYSA-N
MW279.62 g/mol
LogP3.33
Rot. Bonds1

About [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine

[7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine (PubChem CID 62250575) has the molecular formula C10H6ClF4N3 and a molecular weight of 279.62 g/mol. Its IUPAC name is [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine.

Molecular Properties

Compound Name[7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine
PubChem CID62250575
Molecular FormulaC10H6ClF4N3
Molecular Weight279.62 g/mol
Exact Mass279.02
IUPAC Name[7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine
SMILESNNc1cc(C(F)(F)F)nc2c(F)c(Cl)ccc12
InChIInChI=1S/C10H6ClF4N3/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)
InChIKeyNIXSGJRBXMFGKN-UHFFFAOYSA-N
XLogP3.33
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.62
LogP ≤ 53.33
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 [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
The IUPAC name of [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine (CID 62250575) is [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine.
What is the SMILES notation for [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
The canonical SMILES for [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine is NNc1cc(C(F)(F)F)nc2c(F)c(Cl)ccc12.
What is the InChIKey of [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
The InChIKey is NIXSGJRBXMFGKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF4N3/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-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine?
[7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine has a molecular weight of 279.62 g/mol, XLogP of 3.33, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [7-chloro-8-fluoro-2-(trifluoromethyl)quinolin-4-yl]hydrazine is sourced from PubChem (CID 62250575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).