2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine

C13H19BrN2 — CID 84643191

IUPAC2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine
SMILESCNCCC1CCN(C)c2ccc(Br)cc21
InChIInChI=1S/C13H19BrN2/c1-15-7-5-10-6-8-16(2)13-4-3-11(14)9-12(10)13/h3-4,9-10,15H,5-8H2,1-2H3
InChIKeyWPZOLPJXDDYUGM-UHFFFAOYSA-N
MW283.21 g/mol
LogP2.98
Rot. Bonds3

About 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine

2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine (PubChem CID 84643191) has the molecular formula C13H19BrN2 and a molecular weight of 283.21 g/mol. Its IUPAC name is 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine
PubChem CID84643191
Molecular FormulaC13H19BrN2
Molecular Weight283.21 g/mol
Exact Mass282.07
IUPAC Name2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine
SMILESCNCCC1CCN(C)c2ccc(Br)cc21
InChIInChI=1S/C13H19BrN2/c1-15-7-5-10-6-8-16(2)13-4-3-11(14)9-12(10)13/h3-4,9-10,15H,5-8H2,1-2H3
InChIKeyWPZOLPJXDDYUGM-UHFFFAOYSA-N
XLogP2.98
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.21
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)methanamine
CID 82623345
2-(5-bromo-1-ethyl-2,3-dihydroindol-3-yl)-N-methylethanamine
CID 117202262
N-methyl-2-(6-methyl-3,7,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]quinolin-9-yl)ethanamine
CID 84638892
2-(5-chloro-1-methyl-2,3-dihydroindol-3-yl)-N-methylethanamine
CID 117202142
N-methyl-2-(1,7,8-trimethyl-3,4-dihydro-2H-quinolin-4-yl)ethanamine
CID 84627297
(3S)-1-methyl-3-[2-(methylamino)ethyl]pyrrolidin-2-one
CID 122533105
7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine
CID 83843274
5-bromo-2-[4-[2-(methylamino)ethyl]piperidin-1-yl]benzonitrile
CID 114894032
5-bromo-1-methyl-2,3-dihydroindole
CID 19361435
1-(5-bromo-1-methyl-2,3-dihydroindol-3-yl)ethanamine
CID 82277266
2-[1-[4-bromo-2-(trifluoromethyl)phenyl]piperidin-2-yl]-N-methylethanamine
CID 65484017
3-(5-methoxy-1-methyl-2,3-dihydroindol-3-yl)-N-methylpropan-1-amine
CID 117202519

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine?
The IUPAC name of 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine (CID 84643191) is 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine.
What is the SMILES notation for 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine?
The canonical SMILES for 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine is CNCCC1CCN(C)c2ccc(Br)cc21.
What is the InChIKey of 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine?
The InChIKey is WPZOLPJXDDYUGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BrN2/c1-15-7-5-10-6-8-16(2)13-4-3-11(14)9-12(10)13/h3-4,9-10,15H,5-8H2,1-2H3.
What are the key properties of 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine?
2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine has a molecular weight of 283.21 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-methylethanamine is sourced from PubChem (CID 84643191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).