ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate

C18H16Cl2N2O3 — CID 10643415

IUPACethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(C)nc2c(OCc3c(Cl)cccc3Cl)cccn12
InChIInChI=1S/C18H16Cl2N2O3/c1-3-24-18(23)16-11(2)21-17-15(8-5-9-22(16)17)25-10-12-13(19)6-4-7-14(12)20/h4-9H,3,10H2,1-2H3
InChIKeyQAZPOSVSTNVUQG-UHFFFAOYSA-N
MW379.24 g/mol
LogP4.71
Rot. Bonds5

About ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate

ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate (PubChem CID 10643415) has the molecular formula C18H16Cl2N2O3 and a molecular weight of 379.24 g/mol. Its IUPAC name is ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate
PubChem CID10643415
Molecular FormulaC18H16Cl2N2O3
Molecular Weight379.24 g/mol
Exact Mass378.05
IUPAC Nameethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(C)nc2c(OCc3c(Cl)cccc3Cl)cccn12
InChIInChI=1S/C18H16Cl2N2O3/c1-3-24-18(23)16-11(2)21-17-15(8-5-9-22(16)17)25-10-12-13(19)6-4-7-14(12)20/h4-9H,3,10H2,1-2H3
InChIKeyQAZPOSVSTNVUQG-UHFFFAOYSA-N
XLogP4.71
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.24
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate (CID 10643415) is ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate is CCOC(=O)c1c(C)nc2c(OCc3c(Cl)cccc3Cl)cccn12.
What is the InChIKey of ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate?
The InChIKey is QAZPOSVSTNVUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N2O3/c1-3-24-18(23)16-11(2)21-17-15(8-5-9-22(16)17)25-10-12-13(19)6-4-7-14(12)20/h4-9H,3,10H2,1-2H3.
What are the key properties of ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate?
ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate has a molecular weight of 379.24 g/mol, XLogP of 4.71, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 8-[(2,6-dichlorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxylate is sourced from PubChem (CID 10643415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).