ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate

C16H14N2O3 — CID 21280357

IUPACethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(-c2ccc(O)cc2)nc2ccccn12
InChIInChI=1S/C16H14N2O3/c1-2-21-16(20)15-14(11-6-8-12(19)9-7-11)17-13-5-3-4-10-18(13)15/h3-10,19H,2H2,1H3
InChIKeyPCBOHMZPXPZYOX-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.88
Rot. Bonds3

About ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate

ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate (PubChem CID 21280357) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
PubChem CID21280357
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Nameethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(-c2ccc(O)cc2)nc2ccccn12
InChIInChI=1S/C16H14N2O3/c1-2-21-16(20)15-14(11-6-8-12(19)9-7-11)17-13-5-3-4-10-18(13)15/h3-10,19H,2H2,1H3
InChIKeyPCBOHMZPXPZYOX-UHFFFAOYSA-N
XLogP2.88
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
CID 52988808
ethyl 2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 10108596
ethyl 2-bromoimidazo[1,2-a]pyridine-3-carboxylate
CID 131383872
ethyl 2-phenylimidazo[1,2-c]pyrimidine-3-carboxylate
CID 137355302
methyl 2-(4-fluorophenyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 11807750
ethyl 2-phenylimidazo[1,2-b]pyridazine-3-carboxylate
CID 14743338
ethyl 6-phenylimidazo[2,1-b][1,3]thiazole-5-carboxylate
CID 10802132
ethyl 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-2-oxoacetate
CID 75480680
ethyl 6-hydroxy-2-methylimidazo[1,2-a]pyridine-3-carboxylate
CID 131537872
ethyl 4-[(2-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)carbamoylamino]benzoate
CID 50847843
(2-ethylimidazo[1,2-a]pyridin-3-yl)-(4-hydroxyphenyl)methanone;hydrochloride
CID 21145966
ethyl 3-phenyl-1,4,8-triazatricyclo[7.4.0.02,7]trideca-2,4,6,8,10,12-hexaene-5-carboxylate
CID 10591570

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate (CID 21280357) is ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate is CCOC(=O)c1c(-c2ccc(O)cc2)nc2ccccn12.
What is the InChIKey of ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate?
The InChIKey is PCBOHMZPXPZYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-2-21-16(20)15-14(11-6-8-12(19)9-7-11)17-13-5-3-4-10-18(13)15/h3-10,19H,2H2,1H3.
What are the key properties of ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate?
ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate has a molecular weight of 282.30 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate is sourced from PubChem (CID 21280357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).