About 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide
4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide (PubChem CID 110364786) has the molecular formula C14H25N3O2
and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide.
Molecular Properties
| Compound Name | 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide |
| PubChem CID | 110364786 |
| Molecular Formula | C14H25N3O2 |
| Molecular Weight | 267.37 g/mol |
| Exact Mass | 267.19 |
| IUPAC Name | 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide |
| SMILES | CCCNC(=O)N1CCN(C(=O)C2CCCC2)CC1 |
| InChI | InChI=1S/C14H25N3O2/c1-2-7-15-14(19)17-10-8-16(9-11-17)13(18)12-5-3-4-6-12/h12H,2-11H2,1H3,(H,15,19) |
| InChIKey | PRHWKWFYAKBCNX-UHFFFAOYSA-N |
| XLogP | 1.44 |
| TPSA | 52.65 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.37 |
| LogP ≤ 5 | 1.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
The IUPAC name of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide (CID 110364786) is 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
The canonical SMILES for 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide is CCCNC(=O)N1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
The InChIKey is PRHWKWFYAKBCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-2-7-15-14(19)17-10-8-16(9-11-17)13(18)12-5-3-4-6-12/h12H,2-11H2,1H3,(H,15,19).
What are the key properties of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide is sourced from PubChem (CID 110364786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).