ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate

C18H18N2O3 — CID 156579945

IUPACethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate
SMILESCCOC(=O)Cc1nc2ccccn2c1-c1ccccc1OC
InChIInChI=1S/C18H18N2O3/c1-3-23-17(21)12-14-18(13-8-4-5-9-15(13)22-2)20-11-7-6-10-16(20)19-14/h4-11H,3,12H2,1-2H3
InChIKeyPTHLEJLXXRFPCF-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.12
Rot. Bonds5

About ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate

ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate (PubChem CID 156579945) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate
PubChem CID156579945
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Nameethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate
SMILESCCOC(=O)Cc1nc2ccccn2c1-c1ccccc1OC
InChIInChI=1S/C18H18N2O3/c1-3-23-17(21)12-14-18(13-8-4-5-9-15(13)22-2)20-11-7-6-10-16(20)19-14/h4-11H,3,12H2,1-2H3
InChIKeyPTHLEJLXXRFPCF-UHFFFAOYSA-N
XLogP3.12
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 10108596
ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate
CID 15336769
[2-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199536
ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate
CID 171788302
ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
CID 52988808
ethyl 2-[2-(2-methoxyphenyl)-1-(4-methylphenyl)imidazol-4-yl]acetate
CID 11537595
ethyl 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-2-oxoacetate
CID 75480680
ethyl 2-bromoimidazo[1,2-a]pyridine-3-carboxylate
CID 131383872
methyl 2-[(3-ethylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoate
CID 123789390
2-[2-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide
CID 166500960
ethyl 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoate
CID 84561935
2-(2-ethoxycarbonylimidazo[1,2-a]pyridin-3-yl)acetic acid
CID 134969291

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate?
The IUPAC name of ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate (CID 156579945) is ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate.
What is the SMILES notation for ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate?
The canonical SMILES for ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate is CCOC(=O)Cc1nc2ccccn2c1-c1ccccc1OC.
What is the InChIKey of ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate?
The InChIKey is PTHLEJLXXRFPCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-3-23-17(21)12-14-18(13-8-4-5-9-15(13)22-2)20-11-7-6-10-16(20)19-14/h4-11H,3,12H2,1-2H3.
What are the key properties of ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate?
ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate has a molecular weight of 310.35 g/mol, XLogP of 3.12, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate is sourced from PubChem (CID 156579945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).