About [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol
[2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 43478072) has the molecular formula C13H19N3O
and a molecular weight of 233.31 g/mol. Its IUPAC name is [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol.
Molecular Properties
| Compound Name | [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol |
| PubChem CID | 43478072 |
| Molecular Formula | C13H19N3O |
| Molecular Weight | 233.31 g/mol |
| Exact Mass | 233.15 |
| IUPAC Name | [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol |
| SMILES | CCCCN(C)c1nc2ccccn2c1CO |
| InChI | InChI=1S/C13H19N3O/c1-3-4-8-15(2)13-11(10-17)16-9-6-5-7-12(16)14-13/h5-7,9,17H,3-4,8,10H2,1-2H3 |
| InChIKey | OCVDPQFWJHXKAE-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 40.77 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.31 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol (CID 43478072) is [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol is CCCCN(C)c1nc2ccccn2c1CO.
What is the InChIKey of [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is OCVDPQFWJHXKAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-3-4-8-15(2)13-11(10-17)16-9-6-5-7-12(16)14-13/h5-7,9,17H,3-4,8,10H2,1-2H3.
What are the key properties of [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol?
[2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 233.31 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[butyl(methyl)amino]imidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 43478072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).