ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride

C11H13ClN2O2 — CID 52988808

IUPACethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
SMILESCCOC(=O)c1c(C)nc2ccccn12.Cl
InChIInChI=1S/C11H12N2O2.ClH/c1-3-15-11(14)10-8(2)12-9-6-4-5-7-13(9)10;/h4-7H,3H2,1-2H3;1H
InChIKeyIFFLQVBYTDQKNJ-UHFFFAOYSA-N
MW240.69 g/mol
LogP2.24
Rot. Bonds2

About ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride

ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride (PubChem CID 52988808) has the molecular formula C11H13ClN2O2 and a molecular weight of 240.69 g/mol. Its IUPAC name is ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride.

Molecular Properties

Compound Nameethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
PubChem CID52988808
Molecular FormulaC11H13ClN2O2
Molecular Weight240.69 g/mol
Exact Mass240.07
IUPAC Nameethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
SMILESCCOC(=O)c1c(C)nc2ccccn12.Cl
InChIInChI=1S/C11H12N2O2.ClH/c1-3-15-11(14)10-8(2)12-9-6-4-5-7-13(9)10;/h4-7H,3H2,1-2H3;1H
InChIKeyIFFLQVBYTDQKNJ-UHFFFAOYSA-N
XLogP2.24
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-bromoimidazo[1,2-a]pyridine-3-carboxylate
CID 131383872
ethyl 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-2-oxoacetate
CID 75480680
ethyl 2-(4-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 21280357
ethyl 2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 10108596
ethyl 6-hydroxy-2-methylimidazo[1,2-a]pyridine-3-carboxylate
CID 131537872
N-ethyl-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 789702
2-(2-ethoxycarbonylimidazo[1,2-a]pyridin-3-yl)acetic acid
CID 134969291
ethyl 4-methyl-1,3,8-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaene-5-carboxylate
CID 86059330
2-(methylamino)-1-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 84777303
ethane;ethyl (E)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)prop-2-enoate
CID 91168931
ethyl 3-(cyanomethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 82054865
ethyl 3-cyclopropylimidazo[1,2-a]pyridine-2-carboxylate
CID 67953969

Frequently Asked Questions

What is the IUPAC name of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride?
The IUPAC name of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride (CID 52988808) is ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride.
What is the SMILES notation for ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride?
The canonical SMILES for ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride is CCOC(=O)c1c(C)nc2ccccn12.Cl.
What is the InChIKey of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride?
The InChIKey is IFFLQVBYTDQKNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2.ClH/c1-3-15-11(14)10-8(2)12-9-6-4-5-7-13(9)10;/h4-7H,3H2,1-2H3;1H.
What are the key properties of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride?
ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride has a molecular weight of 240.69 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride is sourced from PubChem (CID 52988808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).