5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine

C15H13ClN2O2 — CID 117255753

IUPAC5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCOc1cccc(OCc2cn3c(Cl)cccc3n2)c1
InChIInChI=1S/C15H13ClN2O2/c1-19-12-4-2-5-13(8-12)20-10-11-9-18-14(16)6-3-7-15(18)17-11/h2-9H,10H2,1H3
InChIKeyVHTNTDOGCUPSPX-UHFFFAOYSA-N
MW288.73 g/mol
LogP3.58
Rot. Bonds4

About 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine

5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine (PubChem CID 117255753) has the molecular formula C15H13ClN2O2 and a molecular weight of 288.73 g/mol. Its IUPAC name is 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine
PubChem CID117255753
Molecular FormulaC15H13ClN2O2
Molecular Weight288.73 g/mol
Exact Mass288.07
IUPAC Name5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine
SMILESCOc1cccc(OCc2cn3c(Cl)cccc3n2)c1
InChIInChI=1S/C15H13ClN2O2/c1-19-12-4-2-5-13(8-12)20-10-11-9-18-14(16)6-3-7-15(18)17-11/h2-9H,10H2,1H3
InChIKeyVHTNTDOGCUPSPX-UHFFFAOYSA-N
XLogP3.58
TPSA35.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-2-(pyridin-3-yloxymethyl)imidazo[1,2-a]pyridine
CID 117255772
4-[(5-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]benzaldehyde
CID 22344627
methyl 2-[(3-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255825
5-chloro-2-[(2-fluorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 117255731
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255839
2-(bromomethyl)-5-chloroimidazo[1,2-a]pyridine;hydrobromide
CID 137347572
5-(2-chloro-4-methoxyphenyl)-2-ethylimidazo[1,2-a]pyridine
CID 142507774
methyl 2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-7-carboxylate
CID 117256448
1-(5-chloroimidazo[1,2-a]pyridin-2-yl)propan-2-one
CID 137347473
2-(5-chloroimidazo[1,2-a]pyridin-2-yl)-N,N-dimethylethanamine
CID 117133330
propan-2-yl 2-(5-chloroimidazo[1,2-a]pyridin-2-yl)acetate
CID 135395941
2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117255822

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine (CID 117255753) is 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine is COc1cccc(OCc2cn3c(Cl)cccc3n2)c1.
What is the InChIKey of 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine?
The InChIKey is VHTNTDOGCUPSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O2/c1-19-12-4-2-5-13(8-12)20-10-11-9-18-14(16)6-3-7-15(18)17-11/h2-9H,10H2,1H3.
What are the key properties of 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine?
5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine has a molecular weight of 288.73 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[(3-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 117255753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).