5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine

C9H8BrClN2O — CID 134818940

IUPAC5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine
SMILESCOc1ccc2nc(CCl)cn2c1Br
InChIInChI=1S/C9H8BrClN2O/c1-14-7-2-3-8-12-6(4-11)5-13(8)9(7)10/h2-3,5H,4H2,1H3
InChIKeyGFIOWRIFDCJJQS-UHFFFAOYSA-N
MW275.53 g/mol
LogP2.84
Rot. Bonds2

About 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine

5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine (PubChem CID 134818940) has the molecular formula C9H8BrClN2O and a molecular weight of 275.53 g/mol. Its IUPAC name is 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine
PubChem CID134818940
Molecular FormulaC9H8BrClN2O
Molecular Weight275.53 g/mol
Exact Mass273.95
IUPAC Name5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine
SMILESCOc1ccc2nc(CCl)cn2c1Br
InChIInChI=1S/C9H8BrClN2O/c1-14-7-2-3-8-12-6(4-11)5-13(8)9(7)10/h2-3,5H,4H2,1H3
InChIKeyGFIOWRIFDCJJQS-UHFFFAOYSA-N
XLogP2.84
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.53
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3-[(5-bromo-2-methoxyphenyl)methyl]-2-(chloromethyl)imidazo[1,2-a]pyridine
CID 22091469
6-chloro-3-(chloromethyl)-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridine
CID 39133106
3-bromo-6-methoxyimidazo[1,2-a]pyridine-2-carboxylic acid
CID 83693958
ethyl 3-bromo-6-chloroimidazo[1,2-a]pyridine-2-carboxylate
CID 5260614
3-(chloromethyl)-2,6-dimethylimidazo[1,2-a]pyridine;hydrochloride
CID 82530392
[6-chloro-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199396
6-bromo-2-(3-chlorophenyl)-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 51360616
2-(3-bromophenyl)-6-chloro-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 51360607
methyl 3-bromo-6-chloroimidazo[1,2-a]pyridine-2-carboxylate
CID 46948729
2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine
CID 19367133
2-[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-5-yl]ethynyl-trimethylsilane
CID 147263717
(5-methoxyimidazo[1,2-a]pyridin-2-yl)methanamine
CID 82599470

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine?
The IUPAC name of 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine (CID 134818940) is 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine?
The canonical SMILES for 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine is COc1ccc2nc(CCl)cn2c1Br.
What is the InChIKey of 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine?
The InChIKey is GFIOWRIFDCJJQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrClN2O/c1-14-7-2-3-8-12-6(4-11)5-13(8)9(7)10/h2-3,5H,4H2,1H3.
What are the key properties of 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine?
5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine has a molecular weight of 275.53 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(chloromethyl)-6-methoxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 134818940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).