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

C10H11BrClN — CID 124676937

IUPAC(4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
SMILESC[C@@H]1CCNc2c(Cl)cc(Br)cc21
InChIInChI=1S/C10H11BrClN/c1-6-2-3-13-10-8(6)4-7(11)5-9(10)12/h4-6,13H,2-3H2,1H3/t6-/m1/s1
InChIKeyQUQQBOFLPODBLA-ZCFIWIBFSA-N
MW260.56 g/mol
LogP4.02
Rot. Bonds

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

(4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 124676937) has the molecular formula C10H11BrClN and a molecular weight of 260.56 g/mol. Its IUPAC name is (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name(4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID124676937
Molecular FormulaC10H11BrClN
Molecular Weight260.56 g/mol
Exact Mass258.98
IUPAC Name(4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
SMILESC[C@@H]1CCNc2c(Cl)cc(Br)cc21
InChIInChI=1S/C10H11BrClN/c1-6-2-3-13-10-8(6)4-7(11)5-9(10)12/h4-6,13H,2-3H2,1H3/t6-/m1/s1
InChIKeyQUQQBOFLPODBLA-ZCFIWIBFSA-N
XLogP4.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.56
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

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Related Compounds

7-bromo-5-chloro-1-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochloride
CID 167735922
7-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
CID 16744775
6-chloro-7-methoxy-4-methyl-1,2,3,4-tetrahydroquinoline
CID 126978992
2-[(2R)-azetidin-2-yl]-4-bromo-6-chlorophenol
CID 130673866
4,8-dichloro-6-iodo-1,2,3,4-tetrahydroquinoline
CID 130820660
5,8-dibromo-4-methyl-1,2,3,4-tetrahydroquinoline
CID 126978984
8-chloro-6-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
CID 131050920
4-methyl-1,2,3,4-tetrahydroquinolin-8-amine
CID 119095098
3-(5-bromo-3-chloro-2-methoxyphenyl)pyrrolidine
CID 117469664
8-bromo-4,6-dichloro-1,2,3,4-tetrahydroquinoline
CID 131053038
6-benzyl-8-fluoro-4-methyl-1,2,3,4-tetrahydroquinoline;ethane
CID 142306693
(2S)-2-(4-bromo-2-chlorophenyl)azetidine
CID 130624540

Frequently Asked Questions

What is the IUPAC name of (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline (CID 124676937) is (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline is C[C@@H]1CCNc2c(Cl)cc(Br)cc21.
What is the InChIKey of (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is QUQQBOFLPODBLA-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H11BrClN/c1-6-2-3-13-10-8(6)4-7(11)5-9(10)12/h4-6,13H,2-3H2,1H3/t6-/m1/s1.
What are the key properties of (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline?
(4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 260.56 g/mol, XLogP of 4.02, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-bromo-8-chloro-4-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 124676937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).