8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine

C15H13BrN2O — CID 117256691

IUPAC8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(OCc2cn3cccc(Br)c3n2)cc1
InChIInChI=1S/C15H13BrN2O/c1-11-4-6-13(7-5-11)19-10-12-9-18-8-2-3-14(16)15(18)17-12/h2-9H,10H2,1H3
InChIKeyWVHAXSUDPMFGRH-UHFFFAOYSA-N
MW317.19 g/mol
LogP3.98
Rot. Bonds3

About 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine

8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 117256691) has the molecular formula C15H13BrN2O and a molecular weight of 317.19 g/mol. Its IUPAC name is 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID117256691
Molecular FormulaC15H13BrN2O
Molecular Weight317.19 g/mol
Exact Mass316.02
IUPAC Name8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(OCc2cn3cccc(Br)c3n2)cc1
InChIInChI=1S/C15H13BrN2O/c1-11-4-6-13(7-5-11)19-10-12-9-18-8-2-3-14(16)15(18)17-12/h2-9H,10H2,1H3
InChIKeyWVHAXSUDPMFGRH-UHFFFAOYSA-N
XLogP3.98
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.19
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-4-[(4-methylphenoxy)methyl]-1-propan-2-ylimidazole
CID 117191965
(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-(4-methylphenoxy)propanoate
CID 55475171
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 117256766
8-bromo-2-(methylsulfanylmethyl)imidazo[1,2-a]pyridine
CID 117256707
2-(8-bromoimidazo[1,2-a]pyridin-2-yl)ethanol
CID 115044020
1-[4-[(8-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]ethanone
CID 82529673
N-methoxy-N-methyl-4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 134028089
(2R)-1-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methylamino]propan-2-ol
CID 95041192
3-[[1-[(8-bromoimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]methoxy]phenol
CID 166366593
N'-[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]pyridine-3-carbohydrazide
CID 42093656
2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 28602482
2-[(2,6-dichlorophenoxy)methyl]-8-methylimidazo[1,2-a]pyridine
CID 24675023

Frequently Asked Questions

What is the IUPAC name of 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine (CID 117256691) is 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine is Cc1ccc(OCc2cn3cccc(Br)c3n2)cc1.
What is the InChIKey of 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is WVHAXSUDPMFGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O/c1-11-4-6-13(7-5-11)19-10-12-9-18-8-2-3-14(16)15(18)17-12/h2-9H,10H2,1H3.
What are the key properties of 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine has a molecular weight of 317.19 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2-[(4-methylphenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 117256691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).