1-bromo-9-chloroimidazo[1,2-a]quinoline

C11H6BrClN2 — CID 115051776

IUPAC1-bromo-9-chloroimidazo[1,2-a]quinoline
SMILESClc1cccc2ccc3ncc(Br)n3c12
InChIInChI=1S/C11H6BrClN2/c12-9-6-14-10-5-4-7-2-1-3-8(13)11(7)15(9)10/h1-6H
InChIKeyJTRASRWKXIOLBT-UHFFFAOYSA-N
MW281.54 g/mol
LogP3.90
Rot. Bonds

About 1-bromo-9-chloroimidazo[1,2-a]quinoline

1-bromo-9-chloroimidazo[1,2-a]quinoline (PubChem CID 115051776) has the molecular formula C11H6BrClN2 and a molecular weight of 281.54 g/mol. Its IUPAC name is 1-bromo-9-chloroimidazo[1,2-a]quinoline.

Molecular Properties

Compound Name1-bromo-9-chloroimidazo[1,2-a]quinoline
PubChem CID115051776
Molecular FormulaC11H6BrClN2
Molecular Weight281.54 g/mol
Exact Mass279.94
IUPAC Name1-bromo-9-chloroimidazo[1,2-a]quinoline
SMILESClc1cccc2ccc3ncc(Br)n3c12
InChIInChI=1S/C11H6BrClN2/c12-9-6-14-10-5-4-7-2-1-3-8(13)11(7)15(9)10/h1-6H
InChIKeyJTRASRWKXIOLBT-UHFFFAOYSA-N
XLogP3.90
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.54
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-bromoimidazo[1,2-a]quinolin-9-ol
CID 115049066
3-bromo-5-fluoroimidazo[1,2-a]pyridine
CID 86767811
1-bromo-8-fluoroimidazo[1,2-a]quinoline
CID 115049285
3-bromo-5-chloroimidazo[1,2-a]pyrazine
CID 57415748
3-chloro-5-methylimidazo[1,2-a]pyridine
CID 15470298
1-(5-bromoimidazo[1,2-a]pyridin-3-yl)-N,N-dimethylmethanamine
CID 117255863
3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine
CID 130064917
6-bromo-5-chloroimidazo[1,2-a]pyridin-3-amine
CID 130065565
3-bromo-7-chloroimidazo[2,1-a]isoquinoline
CID 115051768
1,2-dichlorobenzene;naphthalene
CID 162050769
3,5-dibromoimidazo[1,2-f]phenanthridine
CID 118915715
3-bromo-8-chloroquinoline;tetramethylazanium
CID 67706558

Frequently Asked Questions

What is the IUPAC name of 1-bromo-9-chloroimidazo[1,2-a]quinoline?
The IUPAC name of 1-bromo-9-chloroimidazo[1,2-a]quinoline (CID 115051776) is 1-bromo-9-chloroimidazo[1,2-a]quinoline.
What is the SMILES notation for 1-bromo-9-chloroimidazo[1,2-a]quinoline?
The canonical SMILES for 1-bromo-9-chloroimidazo[1,2-a]quinoline is Clc1cccc2ccc3ncc(Br)n3c12.
What is the InChIKey of 1-bromo-9-chloroimidazo[1,2-a]quinoline?
The InChIKey is JTRASRWKXIOLBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrClN2/c12-9-6-14-10-5-4-7-2-1-3-8(13)11(7)15(9)10/h1-6H.
What are the key properties of 1-bromo-9-chloroimidazo[1,2-a]quinoline?
1-bromo-9-chloroimidazo[1,2-a]quinoline has a molecular weight of 281.54 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-9-chloroimidazo[1,2-a]quinoline is sourced from PubChem (CID 115051776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).