8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

C10H9ClF3N — CID 70470776

IUPAC8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
SMILESFC(F)(F)c1cc(Cl)c2c(c1)CCCN2
InChIInChI=1S/C10H9ClF3N/c11-8-5-7(10(12,13)14)4-6-2-1-3-15-9(6)8/h4-5,15H,1-3H2
InChIKeyXHWTXSCLCGVNHP-UHFFFAOYSA-N
MW235.64 g/mol
LogP3.72
Rot. Bonds

About 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 70470776) has the molecular formula C10H9ClF3N and a molecular weight of 235.64 g/mol. Its IUPAC name is 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
PubChem CID70470776
Molecular FormulaC10H9ClF3N
Molecular Weight235.64 g/mol
Exact Mass235.04
IUPAC Name8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
SMILESFC(F)(F)c1cc(Cl)c2c(c1)CCCN2
InChIInChI=1S/C10H9ClF3N/c11-8-5-7(10(12,13)14)4-6-2-1-3-15-9(6)8/h4-5,15H,1-3H2
InChIKeyXHWTXSCLCGVNHP-UHFFFAOYSA-N
XLogP3.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.64
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-chloro-8-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 70470516
5,7-dichloro-2,3-dihydro-1H-indole;hydrochloride
CID 53418200
8-[[3-(trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrahydroquinoline
CID 63970552
8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepine;hydrochloride
CID 71432328
6-bromo-8-fluoro-1,2,3,4-tetrahydroquinoline
CID 16791217
8-chloro-6-(trifluoromethyl)-3,4-dihydro-2H-1,3-benzoxazine
CID 167069080
[2,6-dichloro-4-(trifluoromethyl)phenyl]boranuide
CID 172878584
1,3-dichloro-2-(difluoromethyl)-5-(trifluoromethyl)benzene
CID 171009487
2-chloro-4,6-bis(trifluoromethyl)aniline
CID 21396780
7-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridine
CID 69266032
8-(2,2,2-trifluoroethoxy)-1,2,3,4-tetrahydroquinoline
CID 16781925
8-chloro-1,2,3,4-tetrahydroquinolin-7-amine
CID 84658817

Frequently Asked Questions

What is the IUPAC name of 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline (CID 70470776) is 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline is FC(F)(F)c1cc(Cl)c2c(c1)CCCN2.
What is the InChIKey of 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is XHWTXSCLCGVNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClF3N/c11-8-5-7(10(12,13)14)4-6-2-1-3-15-9(6)8/h4-5,15H,1-3H2.
What are the key properties of 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline?
8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 235.64 g/mol, XLogP of 3.72, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 70470776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).