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

C14H11BrN2O — CID 781520

IUPAC2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine
SMILESBrc1ccc(OCc2cn3ccccc3n2)cc1
InChIInChI=1S/C14H11BrN2O/c15-11-4-6-13(7-5-11)18-10-12-9-17-8-2-1-3-14(17)16-12/h1-9H,10H2
InChIKeyCTVPPZKNPKHWRR-UHFFFAOYSA-N
MW303.16 g/mol
LogP3.68
Rot. Bonds3

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

2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 781520) has the molecular formula C14H11BrN2O and a molecular weight of 303.16 g/mol. Its IUPAC name is 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID781520
Molecular FormulaC14H11BrN2O
Molecular Weight303.16 g/mol
Exact Mass302.01
IUPAC Name2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine
SMILESBrc1ccc(OCc2cn3ccccc3n2)cc1
InChIInChI=1S/C14H11BrN2O/c15-11-4-6-13(7-5-11)18-10-12-9-17-8-2-1-3-14(17)16-12/h1-9H,10H2
InChIKeyCTVPPZKNPKHWRR-UHFFFAOYSA-N
XLogP3.68
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine (CID 781520) is 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine is Brc1ccc(OCc2cn3ccccc3n2)cc1.
What is the InChIKey of 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is CTVPPZKNPKHWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN2O/c15-11-4-6-13(7-5-11)18-10-12-9-17-8-2-1-3-14(17)16-12/h1-9H,10H2.
What are the key properties of 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine?
2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine has a molecular weight of 303.16 g/mol, XLogP of 3.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromophenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 781520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).