8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

C10H10F3N — CID 12647572

IUPAC8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
SMILESFC(F)(F)c1cccc2c1NCCC2
InChIInChI=1S/C10H10F3N/c11-10(12,13)8-5-1-3-7-4-2-6-14-9(7)8/h1,3,5,14H,2,4,6H2
InChIKeyAIZOQUQBOXPVBX-UHFFFAOYSA-N
MW201.19 g/mol
LogP3.06
Rot. Bonds

About 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 12647572) has the molecular formula C10H10F3N and a molecular weight of 201.19 g/mol. Its IUPAC name is 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
PubChem CID12647572
Molecular FormulaC10H10F3N
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
SMILESFC(F)(F)c1cccc2c1NCCC2
InChIInChI=1S/C10H10F3N/c11-10(12,13)8-5-1-3-7-4-2-6-14-9(7)8/h1,3,5,14H,2,4,6H2
InChIKeyAIZOQUQBOXPVBX-UHFFFAOYSA-N
XLogP3.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-Methyl-1,2,3,4-tetrahydroquinoline
CID 66678
1,2,3,4-Tetrahydroquinoline
CID 69460
Julolidine
CID 68069
1,2,3,4-Tetrahydro-4-methylquinoline
CID 86854
2-Methyl-1,2,3,4-tetrahydroquinoline
CID 96289
1-(2-(Trifluoromethyl)phenyl)piperazine
CID 2777670
N,2,6-trimethylaniline
CID 136604
9-fluoro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline
CID 18520432
1-(3,5-Bis(trifluoromethyl)phenyl)piperazine
CID 770558
4',8'-Dimethyl-3',4'-dihydro-1'H-spiro[cyclopentane-1,2'-quinoline] hydrochloride
CID 16681803
1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-ylmethanamine;hydrochloride
CID 24748026
2,3,4,4a,5,6-Hexahydro-9-(trifluoromethyl)-1H-pyrazino(1,2-a)quinoline
CID 125957

Frequently Asked Questions

What is the IUPAC name of 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline (CID 12647572) is 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline is FC(F)(F)c1cccc2c1NCCC2.
What is the InChIKey of 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is AIZOQUQBOXPVBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N/c11-10(12,13)8-5-1-3-7-4-2-6-14-9(7)8/h1,3,5,14H,2,4,6H2.
What are the key properties of 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 201.19 g/mol, XLogP of 3.06, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 12647572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).