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

C15H13BrN2O — CID 28602482

IUPAC2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(OCc2cn3ccccc3n2)c(Br)c1
InChIInChI=1S/C15H13BrN2O/c1-11-5-6-14(13(16)8-11)19-10-12-9-18-7-3-2-4-15(18)17-12/h2-9H,10H2,1H3
InChIKeyGENHCJFYZAOTAY-UHFFFAOYSA-N
MW317.19 g/mol
LogP3.98
Rot. Bonds3

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

2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 28602482) has the molecular formula C15H13BrN2O and a molecular weight of 317.19 g/mol. Its IUPAC name is 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID28602482
Molecular FormulaC15H13BrN2O
Molecular Weight317.19 g/mol
Exact Mass316.02
IUPAC Name2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(OCc2cn3ccccc3n2)c(Br)c1
InChIInChI=1S/C15H13BrN2O/c1-11-5-6-14(13(16)8-11)19-10-12-9-18-7-3-2-4-15(18)17-12/h2-9H,10H2,1H3
InChIKeyGENHCJFYZAOTAY-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-[(2-chloro-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 170746842
1-[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)-5-methylphenyl]ethanamine
CID 60888457
2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 112779233
2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine
CID 1184382
[3,5-dibromo-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methanol
CID 107739058
4,5-dichloro-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)aniline
CID 107497897
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methylbenzonitrile
CID 103760082
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methylbenzoic acid
CID 60698887
(1R)-1-[4-bromo-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]ethanamine
CID 102946838
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052
2-[(7-methylimidazo[1,2-a]pyridin-2-yl)methoxy]aniline
CID 82530102
N-(4-bromo-3-methylphenyl)-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 18266560

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine (CID 28602482) is 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine is Cc1ccc(OCc2cn3ccccc3n2)c(Br)c1.
What is the InChIKey of 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is GENHCJFYZAOTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O/c1-11-5-6-14(13(16)8-11)19-10-12-9-18-7-3-2-4-15(18)17-12/h2-9H,10H2,1H3.
What are the key properties of 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
2-[(2-bromo-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 2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 28602482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).