(2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline

C11H14BrN — CID 125183689

IUPAC(2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline
SMILESCc1cc(Br)cc2c1N[C@H](C)CC2
InChIInChI=1S/C11H14BrN/c1-7-5-10(12)6-9-4-3-8(2)13-11(7)9/h5-6,8,13H,3-4H2,1-2H3/t8-/m1/s1
InChIKeyZKGLULXMSUXBDX-MRVPVSSYSA-N
MW240.14 g/mol
LogP3.50
Rot. Bonds

About (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline

(2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline (PubChem CID 125183689) has the molecular formula C11H14BrN and a molecular weight of 240.14 g/mol. Its IUPAC name is (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name(2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline
PubChem CID125183689
Molecular FormulaC11H14BrN
Molecular Weight240.14 g/mol
Exact Mass239.03
IUPAC Name(2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline
SMILESCc1cc(Br)cc2c1N[C@H](C)CC2
InChIInChI=1S/C11H14BrN/c1-7-5-10(12)6-9-4-3-8(2)13-11(7)9/h5-6,8,13H,3-4H2,1-2H3/t8-/m1/s1
InChIKeyZKGLULXMSUXBDX-MRVPVSSYSA-N
XLogP3.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.14
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline with MolForge

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Related Compounds

2,8-dimethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 154729744
5-bromo-1,7-dimethyl-2,3-dihydro-1H-indene
CID 166534603
7-bromo-2-methyl-1,2,3,4-tetrahydroquinoline
CID 70875781
6-fluoro-2-methyl-1,2,3,4-tetrahydroquinolin-8-amine
CID 58808079
6-bromo-8-methyl-1,2,3,4-tetrahydroquinolin-3-amine
CID 159832251
(2R)-7-chloro-2,6-dimethyl-1,2,3,4-tetrahydroquinoline
CID 96570849
6-bromo-8-methyl-1,2,3,4-tetrahydroquinolin-3-amine;dihydrochloride
CID 159832250
2,6-dimethyl-1,2,3,4-tetrahydroquinoline
CID 13094330
(2R)-6-fluoro-2-methyl-8-nitro-1,2,3,4-tetrahydroquinoline
CID 92982227
6,8-dimethyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid
CID 82396307
(2R,9R)-2-butyl-9-methyl-1,2,3,4,7,8,9,10-octahydro-1,10-phenanthroline
CID 134860782
8-bromo-6,10-dimethyl-2,3,4,4a,5,10a-hexahydro-1H-phenazine
CID 84644248

Frequently Asked Questions

What is the IUPAC name of (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline (CID 125183689) is (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline is Cc1cc(Br)cc2c1N[C@H](C)CC2.
What is the InChIKey of (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is ZKGLULXMSUXBDX-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H14BrN/c1-7-5-10(12)6-9-4-3-8(2)13-11(7)9/h5-6,8,13H,3-4H2,1-2H3/t8-/m1/s1.
What are the key properties of (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline?
(2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 240.14 g/mol, XLogP of 3.50, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-6-bromo-2,8-dimethyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 125183689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).