ethyl imidazo[1,5-a]pyridine-6-carboxylate

C10H10N2O2 — CID 70700985

IUPACethyl imidazo[1,5-a]pyridine-6-carboxylate
SMILESCCOC(=O)c1ccc2cncn2c1
InChIInChI=1S/C10H10N2O2/c1-2-14-10(13)8-3-4-9-5-11-7-12(9)6-8/h3-7H,2H2,1H3
InChIKeyUXHYSOWAFBBJEK-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.51
Rot. Bonds2

About ethyl imidazo[1,5-a]pyridine-6-carboxylate

ethyl imidazo[1,5-a]pyridine-6-carboxylate (PubChem CID 70700985) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is ethyl imidazo[1,5-a]pyridine-6-carboxylate.

Molecular Properties

Compound Nameethyl imidazo[1,5-a]pyridine-6-carboxylate
PubChem CID70700985
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Nameethyl imidazo[1,5-a]pyridine-6-carboxylate
SMILESCCOC(=O)c1ccc2cncn2c1
InChIInChI=1S/C10H10N2O2/c1-2-14-10(13)8-3-4-9-5-11-7-12(9)6-8/h3-7H,2H2,1H3
InChIKeyUXHYSOWAFBBJEK-UHFFFAOYSA-N
XLogP1.51
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl imidazo[1,5-a]pyridine-6-carboxylate?
The IUPAC name of ethyl imidazo[1,5-a]pyridine-6-carboxylate (CID 70700985) is ethyl imidazo[1,5-a]pyridine-6-carboxylate.
What is the SMILES notation for ethyl imidazo[1,5-a]pyridine-6-carboxylate?
The canonical SMILES for ethyl imidazo[1,5-a]pyridine-6-carboxylate is CCOC(=O)c1ccc2cncn2c1.
What is the InChIKey of ethyl imidazo[1,5-a]pyridine-6-carboxylate?
The InChIKey is UXHYSOWAFBBJEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-2-14-10(13)8-3-4-9-5-11-7-12(9)6-8/h3-7H,2H2,1H3.
What are the key properties of ethyl imidazo[1,5-a]pyridine-6-carboxylate?
ethyl imidazo[1,5-a]pyridine-6-carboxylate has a molecular weight of 190.20 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl imidazo[1,5-a]pyridine-6-carboxylate is sourced from PubChem (CID 70700985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).