ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate

C11H12N2O2 — CID 71222577

IUPACethyl 2-imidazo[1,5-a]pyridin-1-ylacetate
SMILESCCOC(=O)Cc1ncn2ccccc12
InChIInChI=1S/C11H12N2O2/c1-2-15-11(14)7-9-10-5-3-4-6-13(10)8-12-9/h3-6,8H,2,7H2,1H3
InChIKeyYGMFUAULVXKAOQ-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.44
Rot. Bonds3

About ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate

ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate (PubChem CID 71222577) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate.

Molecular Properties

Compound Nameethyl 2-imidazo[1,5-a]pyridin-1-ylacetate
PubChem CID71222577
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Nameethyl 2-imidazo[1,5-a]pyridin-1-ylacetate
SMILESCCOC(=O)Cc1ncn2ccccc12
InChIInChI=1S/C11H12N2O2/c1-2-15-11(14)7-9-10-5-3-4-6-13(10)8-12-9/h3-6,8H,2,7H2,1H3
InChIKeyYGMFUAULVXKAOQ-UHFFFAOYSA-N
XLogP1.44
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(imidazo[1,5-a]pyridin-1-ylmethyl)ethanamine
CID 156748875
N-(imidazo[1,5-a]pyridin-1-ylmethyl)propan-1-amine
CID 167286765
ethyl 2-(3-ethyl-4-oxophthalazin-1-yl)acetate
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ethyl 2-[3-(hydroxymethyl)-4-oxophthalazin-1-yl]acetate
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ethyl 2-pyrazolo[1,5-a]pyridin-2-ylacetate
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CID 4065674
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ethyl 2-[3-(2-amino-2-sulfanylideneethyl)-4-oxophthalazin-1-yl]acetate
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CID 140674199

Frequently Asked Questions

What is the IUPAC name of ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate?
The IUPAC name of ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate (CID 71222577) is ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate.
What is the SMILES notation for ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate?
The canonical SMILES for ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate is CCOC(=O)Cc1ncn2ccccc12.
What is the InChIKey of ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate?
The InChIKey is YGMFUAULVXKAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-2-15-11(14)7-9-10-5-3-4-6-13(10)8-12-9/h3-6,8H,2,7H2,1H3.
What are the key properties of ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate?
ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate has a molecular weight of 204.23 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-imidazo[1,5-a]pyridin-1-ylacetate is sourced from PubChem (CID 71222577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).