1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline

C13H11BrN2O — CID 115052800

IUPAC1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline
SMILESCOc1ccc2c(ccc3nc(C)c(Br)n32)c1
InChIInChI=1S/C13H11BrN2O/c1-8-13(14)16-11-5-4-10(17-2)7-9(11)3-6-12(16)15-8/h3-7H,1-2H3
InChIKeyPUXUDUJYWFIQAB-UHFFFAOYSA-N
MW291.15 g/mol
LogP3.57
Rot. Bonds1

About 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline

1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline (PubChem CID 115052800) has the molecular formula C13H11BrN2O and a molecular weight of 291.15 g/mol. Its IUPAC name is 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline.

Molecular Properties

Compound Name1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline
PubChem CID115052800
Molecular FormulaC13H11BrN2O
Molecular Weight291.15 g/mol
Exact Mass290.01
IUPAC Name1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline
SMILESCOc1ccc2c(ccc3nc(C)c(Br)n32)c1
InChIInChI=1S/C13H11BrN2O/c1-8-13(14)16-11-5-4-10(17-2)7-9(11)3-6-12(16)15-8/h3-7H,1-2H3
InChIKeyPUXUDUJYWFIQAB-UHFFFAOYSA-N
XLogP3.57
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.15
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-8-fluoro-2-methylimidazo[1,2-a]quinoline
CID 115051375
2-methoxybenzimidazolo[1,2-a]quinoline
CID 11521634
5-methoxy-1-methylindole
CID 819864
1-bromo-6-methoxy-3-methylisoquinoline
CID 165441613
5-methoxy-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]indole
CID 116619485
2-methoxy-6-[(2-methylpropan-2-yl)oxy]naphthalene
CID 155296690
3-ethyl-7-methoxy-2-methylquinoline
CID 90882709
3,6-dimethoxy-1-methylisoquinoline
CID 169285036
2-bromo-6-methoxyimidazo[1,2-a]pyridine
CID 46737967
5-methoxy-1-[(5-methyl-3-pyridinyl)methyl]indole
CID 102879209
9-methoxy-6-phenylindolo[1,2-a]quinoline
CID 71507368
1-[(2-bromo-5-methoxyphenyl)methyl]-5-methylindole
CID 116622881

Frequently Asked Questions

What is the IUPAC name of 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline?
The IUPAC name of 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline (CID 115052800) is 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline.
What is the SMILES notation for 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline?
The canonical SMILES for 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline is COc1ccc2c(ccc3nc(C)c(Br)n32)c1.
What is the InChIKey of 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline?
The InChIKey is PUXUDUJYWFIQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrN2O/c1-8-13(14)16-11-5-4-10(17-2)7-9(11)3-6-12(16)15-8/h3-7H,1-2H3.
What are the key properties of 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline?
1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline has a molecular weight of 291.15 g/mol, XLogP of 3.57, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-7-methoxy-2-methylimidazo[1,2-a]quinoline is sourced from PubChem (CID 115052800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).