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

C14H10BrClN2O — CID 112779233

IUPAC2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
SMILESClc1cc(Br)ccc1OCc1cn2ccccc2n1
InChIInChI=1S/C14H10BrClN2O/c15-10-4-5-13(12(16)7-10)19-9-11-8-18-6-2-1-3-14(18)17-11/h1-8H,9H2
InChIKeyZRBAQIQHMFIQRO-UHFFFAOYSA-N
MW337.60 g/mol
LogP4.33
Rot. Bonds3

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

2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 112779233) has the molecular formula C14H10BrClN2O and a molecular weight of 337.60 g/mol. Its IUPAC name is 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID112779233
Molecular FormulaC14H10BrClN2O
Molecular Weight337.60 g/mol
Exact Mass335.97
IUPAC Name2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
SMILESClc1cc(Br)ccc1OCc1cn2ccccc2n1
InChIInChI=1S/C14H10BrClN2O/c15-10-4-5-13(12(16)7-10)19-9-11-8-18-6-2-1-3-14(18)17-11/h1-8H,9H2
InChIKeyZRBAQIQHMFIQRO-UHFFFAOYSA-N
XLogP4.33
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.60
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine (CID 112779233) is 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine is Clc1cc(Br)ccc1OCc1cn2ccccc2n1.
What is the InChIKey of 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is ZRBAQIQHMFIQRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClN2O/c15-10-4-5-13(12(16)7-10)19-9-11-8-18-6-2-1-3-14(18)17-11/h1-8H,9H2.
What are the key properties of 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine?
2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine has a molecular weight of 337.60 g/mol, XLogP of 4.33, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 112779233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).