About 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine (PubChem CID 154747124) has the molecular formula C16H19N3
and a molecular weight of 253.35 g/mol. Its IUPAC name is 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine.
Molecular Properties
| Compound Name | 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine |
| PubChem CID | 154747124 |
| Molecular Formula | C16H19N3 |
| Molecular Weight | 253.35 g/mol |
| Exact Mass | 253.16 |
| IUPAC Name | 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine |
| SMILES | CC(=Cc1ccccc1)CN1CCn2cncc2C1 |
| InChI | InChI=1S/C16H19N3/c1-14(9-15-5-3-2-4-6-15)11-18-7-8-19-13-17-10-16(19)12-18/h2-6,9-10,13H,7-8,11-12H2,1H3 |
| InChIKey | HWVWTSYVYFAZNP-UHFFFAOYSA-N |
| XLogP | 2.80 |
| TPSA | 21.06 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 253.35 |
| LogP ≤ 5 | 2.80 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The IUPAC name of 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine (CID 154747124) is 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine.
What is the SMILES notation for 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The canonical SMILES for 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine is CC(=Cc1ccccc1)CN1CCn2cncc2C1.
What is the InChIKey of 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The InChIKey is HWVWTSYVYFAZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-14(9-15-5-3-2-4-6-15)11-18-7-8-19-13-17-10-16(19)12-18/h2-6,9-10,13H,7-8,11-12H2,1H3.
What are the key properties of 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine has a molecular weight of 253.35 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methyl-3-phenylprop-2-enyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine is sourced from PubChem (CID 154747124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).