5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine

C14H10ClFN2O — CID 117255731

IUPAC5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine
SMILESFc1ccccc1OCc1cn2c(Cl)cccc2n1
InChIInChI=1S/C14H10ClFN2O/c15-13-6-3-7-14-17-10(8-18(13)14)9-19-12-5-2-1-4-11(12)16/h1-8H,9H2
InChIKeyKOYMXHOZVPUUJR-UHFFFAOYSA-N
MW276.70 g/mol
LogP3.71
Rot. Bonds3

About 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine

5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 117255731) has the molecular formula C14H10ClFN2O and a molecular weight of 276.70 g/mol. Its IUPAC name is 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID117255731
Molecular FormulaC14H10ClFN2O
Molecular Weight276.70 g/mol
Exact Mass276.05
IUPAC Name5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine
SMILESFc1ccccc1OCc1cn2c(Cl)cccc2n1
InChIInChI=1S/C14H10ClFN2O/c15-13-6-3-7-14-17-10(8-18(13)14)9-19-12-5-2-1-4-11(12)16/h1-8H,9H2
InChIKeyKOYMXHOZVPUUJR-UHFFFAOYSA-N
XLogP3.71
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.70
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine (CID 117255731) is 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine is Fc1ccccc1OCc1cn2c(Cl)cccc2n1.
What is the InChIKey of 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is KOYMXHOZVPUUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFN2O/c15-13-6-3-7-14-17-10(8-18(13)14)9-19-12-5-2-1-4-11(12)16/h1-8H,9H2.
What are the key properties of 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine?
5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine has a molecular weight of 276.70 g/mol, XLogP of 3.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 117255731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).