About 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine
2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine (PubChem CID 117144867) has the molecular formula C11H14ClN3
and a molecular weight of 223.71 g/mol. Its IUPAC name is 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine.
Molecular Properties
| Compound Name | 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine |
| PubChem CID | 117144867 |
| Molecular Formula | C11H14ClN3 |
| Molecular Weight | 223.71 g/mol |
| Exact Mass | 223.09 |
| IUPAC Name | 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine |
| SMILES | CN(C)CCc1ncc2cc(Cl)ccn12 |
| InChI | InChI=1S/C11H14ClN3/c1-14(2)5-4-11-13-8-10-7-9(12)3-6-15(10)11/h3,6-8H,4-5H2,1-2H3 |
| InChIKey | DHTSXSDGSPDSFD-UHFFFAOYSA-N |
| XLogP | 2.09 |
| TPSA | 20.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 223.71 |
| LogP ≤ 5 | 2.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine (CID 117144867) is 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine is CN(C)CCc1ncc2cc(Cl)ccn12.
What is the InChIKey of 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine?
The InChIKey is DHTSXSDGSPDSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3/c1-14(2)5-4-11-13-8-10-7-9(12)3-6-15(10)11/h3,6-8H,4-5H2,1-2H3.
What are the key properties of 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine?
2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine has a molecular weight of 223.71 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloroimidazo[1,5-a]pyridin-3-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 117144867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).