5,7-difluoro-2-(trifluoromethyl)quinoline

C10H4F5N — CID 11075309

IUPAC5,7-difluoro-2-(trifluoromethyl)quinoline
SMILESFc1cc(F)c2ccc(C(F)(F)F)nc2c1
InChIInChI=1S/C10H4F5N/c11-5-3-7(12)6-1-2-9(10(13,14)15)16-8(6)4-5/h1-4H
InChIKeyMANDGIZZFBIKPQ-UHFFFAOYSA-N
MW233.14 g/mol
LogP3.53
Rot. Bonds

About 5,7-difluoro-2-(trifluoromethyl)quinoline

5,7-difluoro-2-(trifluoromethyl)quinoline (PubChem CID 11075309) has the molecular formula C10H4F5N and a molecular weight of 233.14 g/mol. Its IUPAC name is 5,7-difluoro-2-(trifluoromethyl)quinoline.

Molecular Properties

Compound Name5,7-difluoro-2-(trifluoromethyl)quinoline
PubChem CID11075309
Molecular FormulaC10H4F5N
Molecular Weight233.14 g/mol
Exact Mass233.03
IUPAC Name5,7-difluoro-2-(trifluoromethyl)quinoline
SMILESFc1cc(F)c2ccc(C(F)(F)F)nc2c1
InChIInChI=1S/C10H4F5N/c11-5-3-7(12)6-1-2-9(10(13,14)15)16-8(6)4-5/h1-4H
InChIKeyMANDGIZZFBIKPQ-UHFFFAOYSA-N
XLogP3.53
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.14
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-fluoro-2-(trifluoromethyl)quinoline
CID 11074775
7-chloro-2-(trifluoromethyl)quinoline
CID 11031724
5-chloro-2-(trifluoromethyl)quinoline
CID 10889765
6-methylsulfanyl-2-(trifluoromethyl)quinoline
CID 100988429
2-(trifluoromethyl)quinoline-6,7-diol
CID 135735543
2-(trifluoromethyl)quinolin-7-ol
CID 135463587
5-iodo-2-(trifluoromethyl)quinolin-6-amine
CID 162440825
5-methyl-2-(trifluoromethyl)quinolin-6-amine
CID 150996753
7-chloro-2-(trifluoromethyl)quinoline-4-carboxylic acid
CID 71385990
3-tert-butyl-2-chloro-5,7-difluoroquinoline
CID 55185283
7-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 24947251
6-amino-5-methoxy-2-(trifluoromethyl)quinoline-7-carbaldehyde
CID 89105796

Frequently Asked Questions

What is the IUPAC name of 5,7-difluoro-2-(trifluoromethyl)quinoline?
The IUPAC name of 5,7-difluoro-2-(trifluoromethyl)quinoline (CID 11075309) is 5,7-difluoro-2-(trifluoromethyl)quinoline.
What is the SMILES notation for 5,7-difluoro-2-(trifluoromethyl)quinoline?
The canonical SMILES for 5,7-difluoro-2-(trifluoromethyl)quinoline is Fc1cc(F)c2ccc(C(F)(F)F)nc2c1.
What is the InChIKey of 5,7-difluoro-2-(trifluoromethyl)quinoline?
The InChIKey is MANDGIZZFBIKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4F5N/c11-5-3-7(12)6-1-2-9(10(13,14)15)16-8(6)4-5/h1-4H.
What are the key properties of 5,7-difluoro-2-(trifluoromethyl)quinoline?
5,7-difluoro-2-(trifluoromethyl)quinoline has a molecular weight of 233.14 g/mol, XLogP of 3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-difluoro-2-(trifluoromethyl)quinoline is sourced from PubChem (CID 11075309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).