6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine

C17H17BrN2O — CID 115404928

IUPAC6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
SMILESCc1cc2nc(-c3ccc(OC(C)C)cc3)cn2cc1Br
InChIInChI=1S/C17H17BrN2O/c1-11(2)21-14-6-4-13(5-7-14)16-10-20-9-15(18)12(3)8-17(20)19-16/h4-11H,1-3H3
InChIKeyPOYCCXRQBSQGIF-UHFFFAOYSA-N
MW345.24 g/mol
LogP4.86
Rot. Bonds3

About 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine

6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine (PubChem CID 115404928) has the molecular formula C17H17BrN2O and a molecular weight of 345.24 g/mol. Its IUPAC name is 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
PubChem CID115404928
Molecular FormulaC17H17BrN2O
Molecular Weight345.24 g/mol
Exact Mass344.05
IUPAC Name6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
SMILESCc1cc2nc(-c3ccc(OC(C)C)cc3)cn2cc1Br
InChIInChI=1S/C17H17BrN2O/c1-11(2)21-14-6-4-13(5-7-14)16-10-20-9-15(18)12(3)8-17(20)19-16/h4-11H,1-3H3
InChIKeyPOYCCXRQBSQGIF-UHFFFAOYSA-N
XLogP4.86
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.24
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
CID 46307196
6-bromo-7-methyl-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine
CID 115404929
6-bromo-5-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 115403727
2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060342
[2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanol
CID 82064349
[2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]methanol
CID 82356958
6-bromo-7-methyl-2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 115404807
2-(1-benzothiophen-2-yl)-6-bromo-7-methylimidazo[1,2-a]pyridine
CID 114911433
7-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine
CID 117135502
6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;hydroiodide
CID 19238090
2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine
CID 95466244
5-methyl-3-(4-propan-2-yloxyphenyl)-1H-pyrazole
CID 116856590

Frequently Asked Questions

What is the IUPAC name of 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine (CID 115404928) is 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine is Cc1cc2nc(-c3ccc(OC(C)C)cc3)cn2cc1Br.
What is the InChIKey of 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The InChIKey is POYCCXRQBSQGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17BrN2O/c1-11(2)21-14-6-4-13(5-7-14)16-10-20-9-15(18)12(3)8-17(20)19-16/h4-11H,1-3H3.
What are the key properties of 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine has a molecular weight of 345.24 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 115404928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).