About 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine
1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine (PubChem CID 106575827) has the molecular formula C13H21N3
and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine.
Molecular Properties
| Compound Name | 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine |
| PubChem CID | 106575827 |
| Molecular Formula | C13H21N3 |
| Molecular Weight | 219.33 g/mol |
| Exact Mass | 219.17 |
| IUPAC Name | 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine |
| SMILES | c1cn(C2CCCC2)c(NCCC2CC2)n1 |
| InChI | InChI=1S/C13H21N3/c1-2-4-12(3-1)16-10-9-15-13(16)14-8-7-11-5-6-11/h9-12H,1-8H2,(H,14,15) |
| InChIKey | UIRLEFGOKYQPRJ-UHFFFAOYSA-N |
| XLogP | 3.21 |
| TPSA | 29.85 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 219.33 |
| LogP ≤ 5 | 3.21 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine?
The IUPAC name of 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine (CID 106575827) is 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine is c1cn(C2CCCC2)c(NCCC2CC2)n1.
What is the InChIKey of 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine?
The InChIKey is UIRLEFGOKYQPRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-2-4-12(3-1)16-10-9-15-13(16)14-8-7-11-5-6-11/h9-12H,1-8H2,(H,14,15).
What are the key properties of 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine?
1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine has a molecular weight of 219.33 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine is sourced from PubChem (CID 106575827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).