About 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide
4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide (PubChem CID 65358199) has the molecular formula C15H27N5O
and a molecular weight of 293.41 g/mol. Its IUPAC name is 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide.
Molecular Properties
| Compound Name | 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide |
| PubChem CID | 65358199 |
| Molecular Formula | C15H27N5O |
| Molecular Weight | 293.41 g/mol |
| Exact Mass | 293.22 |
| IUPAC Name | 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide |
| SMILES | CCn1cc(N)c(C(=O)N(CCN(C)C)C2CCCC2)n1 |
| InChI | InChI=1S/C15H27N5O/c1-4-19-11-13(16)14(17-19)15(21)20(10-9-18(2)3)12-7-5-6-8-12/h11-12H,4-10,16H2,1-3H3 |
| InChIKey | RUEUGEBPCVQMHW-UHFFFAOYSA-N |
| XLogP | 1.43 |
| TPSA | 67.39 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.41 |
| LogP ≤ 5 | 1.43 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide (CID 65358199) is 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide is CCn1cc(N)c(C(=O)N(CCN(C)C)C2CCCC2)n1.
What is the InChIKey of 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide?
The InChIKey is RUEUGEBPCVQMHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-4-19-11-13(16)14(17-19)15(21)20(10-9-18(2)3)12-7-5-6-8-12/h11-12H,4-10,16H2,1-3H3.
What are the key properties of 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide?
4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide has a molecular weight of 293.41 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide is sourced from PubChem (CID 65358199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).