4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline

C11H10F3N — CID 170409083

IUPAC4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline
SMILESCC1=c2cccc(C(F)(F)F)c2=NCC1
InChIInChI=1S/C11H10F3N/c1-7-5-6-15-10-8(7)3-2-4-9(10)11(12,13)14/h2-4H,5-6H2,1H3
InChIKeyQIIOZVDOFLJXDW-UHFFFAOYSA-N
MW213.20 g/mol
LogP1.90
Rot. Bonds

About 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline

4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline (PubChem CID 170409083) has the molecular formula C11H10F3N and a molecular weight of 213.20 g/mol. Its IUPAC name is 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline.

Molecular Properties

Compound Name4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline
PubChem CID170409083
Molecular FormulaC11H10F3N
Molecular Weight213.20 g/mol
Exact Mass213.08
IUPAC Name4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline
SMILESCC1=c2cccc(C(F)(F)F)c2=NCC1
InChIInChI=1S/C11H10F3N/c1-7-5-6-15-10-8(7)3-2-4-9(10)11(12,13)14/h2-4H,5-6H2,1H3
InChIKeyQIIOZVDOFLJXDW-UHFFFAOYSA-N
XLogP1.90
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline?
The IUPAC name of 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline (CID 170409083) is 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline.
What is the SMILES notation for 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline?
The canonical SMILES for 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline is CC1=c2cccc(C(F)(F)F)c2=NCC1.
What is the InChIKey of 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline?
The InChIKey is QIIOZVDOFLJXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N/c1-7-5-6-15-10-8(7)3-2-4-9(10)11(12,13)14/h2-4H,5-6H2,1H3.
What are the key properties of 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline?
4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline has a molecular weight of 213.20 g/mol, XLogP of 1.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-8-(trifluoromethyl)-2,3-dihydroquinoline is sourced from PubChem (CID 170409083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).