About N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine
N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine (PubChem CID 106580369) has the molecular formula C10H17N3
and a molecular weight of 179.27 g/mol. Its IUPAC name is N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine.
Molecular Properties
| Compound Name | N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine |
| PubChem CID | 106580369 |
| Molecular Formula | C10H17N3 |
| Molecular Weight | 179.27 g/mol |
| Exact Mass | 179.14 |
| IUPAC Name | N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine |
| SMILES | CCC1(Nc2ncc(C)[nH]2)CCC1 |
| InChI | InChI=1S/C10H17N3/c1-3-10(5-4-6-10)13-9-11-7-8(2)12-9/h7H,3-6H2,1-2H3,(H2,11,12,13) |
| InChIKey | QQLCKSNPEWVRCH-UHFFFAOYSA-N |
| XLogP | 2.46 |
| TPSA | 40.71 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 179.27 |
| LogP ≤ 5 | 2.46 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
The IUPAC name of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine (CID 106580369) is N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine.
What is the SMILES notation for N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
The canonical SMILES for N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine is CCC1(Nc2ncc(C)[nH]2)CCC1.
What is the InChIKey of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
The InChIKey is QQLCKSNPEWVRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-10(5-4-6-10)13-9-11-7-8(2)12-9/h7H,3-6H2,1-2H3,(H2,11,12,13).
What are the key properties of N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine?
N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine has a molecular weight of 179.27 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylcyclobutyl)-5-methyl-1H-imidazol-2-amine is sourced from PubChem (CID 106580369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).