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

C10H11N3O2 — CID 11084975

IUPACethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate
SMILESCCOC(=O)c1nc2ccccn2c1N
InChIInChI=1S/C10H11N3O2/c1-2-15-10(14)8-9(11)13-6-4-3-5-7(13)12-8/h3-6H,2,11H2,1H3
InChIKeyZYZKPUSLGMLJBT-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.09
Rot. Bonds2

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

ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate (PubChem CID 11084975) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate
PubChem CID11084975
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Nameethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate
SMILESCCOC(=O)c1nc2ccccn2c1N
InChIInChI=1S/C10H11N3O2/c1-2-15-10(14)8-9(11)13-6-4-3-5-7(13)12-8/h3-6H,2,11H2,1H3
InChIKeyZYZKPUSLGMLJBT-UHFFFAOYSA-N
XLogP1.09
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate?
The IUPAC name of ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate (CID 11084975) is ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate.
What is the SMILES notation for ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate?
The canonical SMILES for ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate is CCOC(=O)c1nc2ccccn2c1N.
What is the InChIKey of ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate?
The InChIKey is ZYZKPUSLGMLJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-2-15-10(14)8-9(11)13-6-4-3-5-7(13)12-8/h3-6H,2,11H2,1H3.
What are the key properties of ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate?
ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate has a molecular weight of 205.22 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-aminoimidazo[1,2-a]pyridine-2-carboxylate is sourced from PubChem (CID 11084975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).