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

C11H12N2O2 — CID 743829

IUPACethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(C)nc2ccccn12
InChIInChI=1S/C11H12N2O2/c1-3-15-11(14)10-8(2)12-9-6-4-5-7-13(9)10/h4-7H,3H2,1-2H3
InChIKeyFLAQFBICEAEEOA-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.82
Rot. Bonds2

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

ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate (PubChem CID 743829) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate
PubChem CID743829
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Nameethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate
SMILESCCOC(=O)c1c(C)nc2ccccn12
InChIInChI=1S/C11H12N2O2/c1-3-15-11(14)10-8(2)12-9-6-4-5-7-13(9)10/h4-7H,3H2,1-2H3
InChIKeyFLAQFBICEAEEOA-UHFFFAOYSA-N
XLogP1.82
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate?
The IUPAC name of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate (CID 743829) is ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate?
The canonical SMILES for ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate is CCOC(=O)c1c(C)nc2ccccn12.
What is the InChIKey of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate?
The InChIKey is FLAQFBICEAEEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-3-15-11(14)10-8(2)12-9-6-4-5-7-13(9)10/h4-7H,3H2,1-2H3.
What are the key properties of ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate?
ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate has a molecular weight of 204.23 g/mol, XLogP of 1.82, 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 is sourced from PubChem (CID 743829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).