About N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine
N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine (PubChem CID 63756235) has the molecular formula C15H17N5
and a molecular weight of 267.34 g/mol. Its IUPAC name is N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine.
Molecular Properties
| Compound Name | N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine |
| PubChem CID | 63756235 |
| Molecular Formula | C15H17N5 |
| Molecular Weight | 267.34 g/mol |
| Exact Mass | 267.15 |
| IUPAC Name | N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine |
| SMILES | Cc1cnc(CNCc2nc3ccccc3n2C)cn1 |
| InChI | InChI=1S/C15H17N5/c1-11-7-18-12(9-17-11)8-16-10-15-19-13-5-3-4-6-14(13)20(15)2/h3-7,9,16H,8,10H2,1-2H3 |
| InChIKey | GFWFZSUVHJQLHP-UHFFFAOYSA-N |
| XLogP | 1.96 |
| TPSA | 55.63 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.34 |
| LogP ≤ 5 | 1.96 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine?
The IUPAC name of N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine (CID 63756235) is N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine.
What is the SMILES notation for N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine?
The canonical SMILES for N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine is Cc1cnc(CNCc2nc3ccccc3n2C)cn1.
What is the InChIKey of N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine?
The InChIKey is GFWFZSUVHJQLHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-11-7-18-12(9-17-11)8-16-10-15-19-13-5-3-4-6-14(13)20(15)2/h3-7,9,16H,8,10H2,1-2H3.
What are the key properties of N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine?
N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine has a molecular weight of 267.34 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylbenzimidazol-2-yl)methyl]-1-(5-methylpyrazin-2-yl)methanamine is sourced from PubChem (CID 63756235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).