5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine

C17H11BrN2O — CID 102625258

IUPAC5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine
SMILESBrc1ccc2cc(Oc3cccc4nccn34)ccc2c1
InChIInChI=1S/C17H11BrN2O/c18-14-6-4-13-11-15(7-5-12(13)10-14)21-17-3-1-2-16-19-8-9-20(16)17/h1-11H
InChIKeyIHIBJBORFSQGSS-UHFFFAOYSA-N
MW339.19 g/mol
LogP5.04
Rot. Bonds2

About 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine

5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine (PubChem CID 102625258) has the molecular formula C17H11BrN2O and a molecular weight of 339.19 g/mol. Its IUPAC name is 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine
PubChem CID102625258
Molecular FormulaC17H11BrN2O
Molecular Weight339.19 g/mol
Exact Mass338.01
IUPAC Name5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine
SMILESBrc1ccc2cc(Oc3cccc4nccn34)ccc2c1
InChIInChI=1S/C17H11BrN2O/c18-14-6-4-13-11-15(7-5-12(13)10-14)21-17-3-1-2-16-19-8-9-20(16)17/h1-11H
InChIKeyIHIBJBORFSQGSS-UHFFFAOYSA-N
XLogP5.04
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.19
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine?
The IUPAC name of 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine (CID 102625258) is 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine?
The canonical SMILES for 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine is Brc1ccc2cc(Oc3cccc4nccn34)ccc2c1.
What is the InChIKey of 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine?
The InChIKey is IHIBJBORFSQGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrN2O/c18-14-6-4-13-11-15(7-5-12(13)10-14)21-17-3-1-2-16-19-8-9-20(16)17/h1-11H.
What are the key properties of 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine?
5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine has a molecular weight of 339.19 g/mol, XLogP of 5.04, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-bromonaphthalen-2-yl)oxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 102625258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).