About 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine
5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine (PubChem CID 116827598) has the molecular formula C11H17N3
and a molecular weight of 191.28 g/mol. Its IUPAC name is 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine.
Molecular Properties
| Compound Name | 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine |
| PubChem CID | 116827598 |
| Molecular Formula | C11H17N3 |
| Molecular Weight | 191.28 g/mol |
| Exact Mass | 191.14 |
| IUPAC Name | 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine |
| SMILES | Cn1nc(NC2CC2)cc1C1CCC1 |
| InChI | InChI=1S/C11H17N3/c1-14-10(8-3-2-4-8)7-11(13-14)12-9-5-6-9/h7-9H,2-6H2,1H3,(H,12,13) |
| InChIKey | HDJNRDGXZUIVLB-UHFFFAOYSA-N |
| XLogP | 2.26 |
| TPSA | 29.85 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 191.28 |
| LogP ≤ 5 | 2.26 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine?
The IUPAC name of 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine (CID 116827598) is 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine.
What is the SMILES notation for 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine?
The canonical SMILES for 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine is Cn1nc(NC2CC2)cc1C1CCC1.
What is the InChIKey of 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine?
The InChIKey is HDJNRDGXZUIVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-14-10(8-3-2-4-8)7-11(13-14)12-9-5-6-9/h7-9H,2-6H2,1H3,(H,12,13).
What are the key properties of 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine?
5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine has a molecular weight of 191.28 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine is sourced from PubChem (CID 116827598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).