7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine

C13H12ClF3N2 — CID 104722072

IUPAC7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCCNc1cc(C(F)(F)F)nc2cc(Cl)c(C)cc12
InChIInChI=1S/C13H12ClF3N2/c1-3-18-10-6-12(13(15,16)17)19-11-5-9(14)7(2)4-8(10)11/h4-6H,3H2,1-2H3,(H,18,19)
InChIKeyYULDJGBHOLMLSI-UHFFFAOYSA-N
MW288.70 g/mol
LogP4.65
Rot. Bonds2

About 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine

7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine (PubChem CID 104722072) has the molecular formula C13H12ClF3N2 and a molecular weight of 288.70 g/mol. Its IUPAC name is 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine
PubChem CID104722072
Molecular FormulaC13H12ClF3N2
Molecular Weight288.70 g/mol
Exact Mass288.06
IUPAC Name7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCCNc1cc(C(F)(F)F)nc2cc(Cl)c(C)cc12
InChIInChI=1S/C13H12ClF3N2/c1-3-18-10-6-12(13(15,16)17)19-11-5-9(14)7(2)4-8(10)11/h4-6H,3H2,1-2H3,(H,18,19)
InChIKeyYULDJGBHOLMLSI-UHFFFAOYSA-N
XLogP4.65
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.70
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine 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-2-(difluoromethyl)-N-ethyl-6-methylquinolin-4-amine
CID 113445336
7-chloro-N-ethyl-8-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 55197100
6-bromo-8-chloro-N-ethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63479069
6-chloro-N,2-diethyl-7-fluoroquinolin-4-amine
CID 103996830
N-ethyl-7-fluoro-6-methyl-2-propylquinolin-4-amine
CID 103996204
7-chloro-2-(methoxymethyl)-6-methyl-N-propylquinolin-4-amine
CID 104722052
8-bromo-N-ethyl-5-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 82758076
7-chloro-N,3,6-trimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 104722067
6-chloro-N-ethyl-7-fluoro-2-(methoxymethyl)quinolin-4-amine
CID 113363427
5,8-dichloro-6-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 104728229
7-chloro-2-(difluoromethyl)-N,6-dimethylquinolin-4-amine
CID 113445330
6-bromo-2-tert-butyl-N-ethylquinolin-4-amine
CID 63481640

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine?
The IUPAC name of 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine (CID 104722072) is 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine.
What is the SMILES notation for 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine?
The canonical SMILES for 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine is CCNc1cc(C(F)(F)F)nc2cc(Cl)c(C)cc12.
What is the InChIKey of 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine?
The InChIKey is YULDJGBHOLMLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClF3N2/c1-3-18-10-6-12(13(15,16)17)19-11-5-9(14)7(2)4-8(10)11/h4-6H,3H2,1-2H3,(H,18,19).
What are the key properties of 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine?
7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine has a molecular weight of 288.70 g/mol, XLogP of 4.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-ethyl-6-methyl-2-(trifluoromethyl)quinolin-4-amine is sourced from PubChem (CID 104722072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).