6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine

C15H13BrN2O — CID 117256192

IUPAC6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccccc1OCc1cnc2ccc(Br)cn12
InChIInChI=1S/C15H13BrN2O/c1-11-4-2-3-5-14(11)19-10-13-8-17-15-7-6-12(16)9-18(13)15/h2-9H,10H2,1H3
InChIKeyGRLPMBUHHBJMMT-UHFFFAOYSA-N
MW317.19 g/mol
LogP3.98
Rot. Bonds3

About 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine

6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 117256192) has the molecular formula C15H13BrN2O and a molecular weight of 317.19 g/mol. Its IUPAC name is 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID117256192
Molecular FormulaC15H13BrN2O
Molecular Weight317.19 g/mol
Exact Mass316.02
IUPAC Name6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccccc1OCc1cnc2ccc(Br)cn12
InChIInChI=1S/C15H13BrN2O/c1-11-4-2-3-5-14(11)19-10-13-8-17-15-7-6-12(16)9-18(13)15/h2-9H,10H2,1H3
InChIKeyGRLPMBUHHBJMMT-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

6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 117256189
7-chloro-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 117256505
N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]-2-methylpropan-2-amine
CID 115651962
2-(6-bromoimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 76849622
N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]propan-2-amine
CID 115651289
6-bromo-3-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 129053983
2-(6-bromoimidazo[1,2-a]pyridin-3-yl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 171679111
[2-[[(6-bromoimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]phenyl]methanol
CID 111432960
3-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 117255900
2-(6-bromoimidazo[1,2-a]pyridin-3-yl)-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
CID 154958995
5-bromo-1-[2-(2-methylphenoxy)ethyl]pyridin-2-one
CID 52891668
N-[(6-bromoimidazo[1,2-a]pyridin-3-yl)methyl]cyclopentanamine
CID 117256170

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine (CID 117256192) is 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine is Cc1ccccc1OCc1cnc2ccc(Br)cn12.
What is the InChIKey of 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is GRLPMBUHHBJMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O/c1-11-4-2-3-5-14(11)19-10-13-8-17-15-7-6-12(16)9-18(13)15/h2-9H,10H2,1H3.
What are the key properties of 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine?
6-bromo-3-[(2-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 6-bromo-3-[(2-methylphenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 117256192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).