About 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine
1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine (PubChem CID 62742741) has the molecular formula C10H14N4S
and a molecular weight of 222.32 g/mol. Its IUPAC name is 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine.
Molecular Properties
| Compound Name | 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine |
| PubChem CID | 62742741 |
| Molecular Formula | C10H14N4S |
| Molecular Weight | 222.32 g/mol |
| Exact Mass | 222.09 |
| IUPAC Name | 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine |
| SMILES | Cc1csc(CNCc2cnc(C)[nH]2)n1 |
| InChI | InChI=1S/C10H14N4S/c1-7-6-15-10(13-7)5-11-3-9-4-12-8(2)14-9/h4,6,11H,3,5H2,1-2H3,(H,12,14) |
| InChIKey | FAUYZOQGXZVCGY-UHFFFAOYSA-N |
| XLogP | 1.77 |
| TPSA | 53.60 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.32 |
| LogP ≤ 5 | 1.77 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine?
The IUPAC name of 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine (CID 62742741) is 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine is Cc1csc(CNCc2cnc(C)[nH]2)n1.
What is the InChIKey of 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine?
The InChIKey is FAUYZOQGXZVCGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-7-6-15-10(13-7)5-11-3-9-4-12-8(2)14-9/h4,6,11H,3,5H2,1-2H3,(H,12,14).
What are the key properties of 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine?
1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine has a molecular weight of 222.32 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1H-imidazol-5-yl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]methanamine is sourced from PubChem (CID 62742741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).