6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine

C14H14BrF3N2 — CID 107578764

IUPAC6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCNc1c(C)c(C(F)(F)F)nc2cc(C)c(Br)c(C)c12
InChIInChI=1S/C14H14BrF3N2/c1-6-5-9-10(7(2)11(6)15)12(19-4)8(3)13(20-9)14(16,17)18/h5H,1-4H3,(H,19,20)
InChIKeyGAXBPZRYXIPUOX-UHFFFAOYSA-N
MW347.18 g/mol
LogP4.98
Rot. Bonds1

About 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine

6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine (PubChem CID 107578764) has the molecular formula C14H14BrF3N2 and a molecular weight of 347.18 g/mol. Its IUPAC name is 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine.

Molecular Properties

Compound Name6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine
PubChem CID107578764
Molecular FormulaC14H14BrF3N2
Molecular Weight347.18 g/mol
Exact Mass346.03
IUPAC Name6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCNc1c(C)c(C(F)(F)F)nc2cc(C)c(Br)c(C)c12
InChIInChI=1S/C14H14BrF3N2/c1-6-5-9-10(7(2)11(6)15)12(19-4)8(3)13(20-9)14(16,17)18/h5H,1-4H3,(H,19,20)
InChIKeyGAXBPZRYXIPUOX-UHFFFAOYSA-N
XLogP4.98
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.18
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-6,8-difluoro-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 102854998
7-chloro-N,3,6-trimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 104722067
5,8-difluoro-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743910
6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743568
N,8-dimethyl-7-(trifluoromethyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine
CID 63744415
6-bromo-8-ethyl-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 81289179
[6-bromo-7-fluoro-3-methyl-2-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 103996968
ethyl 6-bromo-5,7-dimethyl-4-(methylamino)quinoline-3-carboxylate
CID 107578642
6-bromo-4-chloro-2,3,5,7-tetramethylquinoline
CID 107577474
6-bromo-N,5,7-trimethylquinolin-2-amine
CID 107579682
5-chloro-8-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743220
N,2,3,5,7-pentamethylquinolin-4-amine
CID 62201677

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine?
The IUPAC name of 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine (CID 107578764) is 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine.
What is the SMILES notation for 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine?
The canonical SMILES for 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine is CNc1c(C)c(C(F)(F)F)nc2cc(C)c(Br)c(C)c12.
What is the InChIKey of 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine?
The InChIKey is GAXBPZRYXIPUOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrF3N2/c1-6-5-9-10(7(2)11(6)15)12(19-4)8(3)13(20-9)14(16,17)18/h5H,1-4H3,(H,19,20).
What are the key properties of 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine?
6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine has a molecular weight of 347.18 g/mol, XLogP of 4.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N,3,5,7-tetramethyl-2-(trifluoromethyl)quinolin-4-amine is sourced from PubChem (CID 107578764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).