2-methyl-3-(trifluoromethyl)quinoline

C11H8F3N — CID 134859716

IUPAC2-methyl-3-(trifluoromethyl)quinoline
SMILESCc1nc2ccccc2cc1C(F)(F)F
InChIInChI=1S/C11H8F3N/c1-7-9(11(12,13)14)6-8-4-2-3-5-10(8)15-7/h2-6H,1H3
InChIKeyWSYOYYPUPOVGON-UHFFFAOYSA-N
MW211.19 g/mol
LogP3.56
Rot. Bonds

About 2-methyl-3-(trifluoromethyl)quinoline

2-methyl-3-(trifluoromethyl)quinoline (PubChem CID 134859716) has the molecular formula C11H8F3N and a molecular weight of 211.19 g/mol. Its IUPAC name is 2-methyl-3-(trifluoromethyl)quinoline.

Molecular Properties

Compound Name2-methyl-3-(trifluoromethyl)quinoline
PubChem CID134859716
Molecular FormulaC11H8F3N
Molecular Weight211.19 g/mol
Exact Mass211.06
IUPAC Name2-methyl-3-(trifluoromethyl)quinoline
SMILESCc1nc2ccccc2cc1C(F)(F)F
InChIInChI=1S/C11H8F3N/c1-7-9(11(12,13)14)6-8-4-2-3-5-10(8)15-7/h2-6H,1H3
InChIKeyWSYOYYPUPOVGON-UHFFFAOYSA-N
XLogP3.56
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.19
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Tacrine
CID 1935
Quinoline
CID 7047
Acridine
CID 9215
6-Methylquinoline
CID 7059
9-Aminoacridine
CID 7019
2-Methylquinoline
CID 7060
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine hydrochloride
CID 8643
4-Methylquinoline
CID 10285
8-Methylquinoline
CID 11910
2,6-Dimethylquinoline
CID 13414
2-Phenylquinoline
CID 71545

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(trifluoromethyl)quinoline?
The IUPAC name of 2-methyl-3-(trifluoromethyl)quinoline (CID 134859716) is 2-methyl-3-(trifluoromethyl)quinoline.
What is the SMILES notation for 2-methyl-3-(trifluoromethyl)quinoline?
The canonical SMILES for 2-methyl-3-(trifluoromethyl)quinoline is Cc1nc2ccccc2cc1C(F)(F)F.
What is the InChIKey of 2-methyl-3-(trifluoromethyl)quinoline?
The InChIKey is WSYOYYPUPOVGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3N/c1-7-9(11(12,13)14)6-8-4-2-3-5-10(8)15-7/h2-6H,1H3.
What are the key properties of 2-methyl-3-(trifluoromethyl)quinoline?
2-methyl-3-(trifluoromethyl)quinoline has a molecular weight of 211.19 g/mol, XLogP of 3.56, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(trifluoromethyl)quinoline is sourced from PubChem (CID 134859716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).