About N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide
N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide (PubChem CID 115605548) has the molecular formula C16H28N2O
and a molecular weight of 264.41 g/mol. Its IUPAC name is N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide.
Molecular Properties
| Compound Name | N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide |
| PubChem CID | 115605548 |
| Molecular Formula | C16H28N2O |
| Molecular Weight | 264.41 g/mol |
| Exact Mass | 264.22 |
| IUPAC Name | N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide |
| SMILES | O=C(NC1CCCC1)N1CCC2(CCCCC2)CC1 |
| InChI | InChI=1S/C16H28N2O/c19-15(17-14-6-2-3-7-14)18-12-10-16(11-13-18)8-4-1-5-9-16/h14H,1-13H2,(H,17,19) |
| InChIKey | HRMNDRVCCQDSRP-UHFFFAOYSA-N |
| XLogP | 3.68 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 264.41 |
| LogP ≤ 5 | 3.68 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
The IUPAC name of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide (CID 115605548) is N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
The canonical SMILES for N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide is O=C(NC1CCCC1)N1CCC2(CCCCC2)CC1.
What is the InChIKey of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
The InChIKey is HRMNDRVCCQDSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c19-15(17-14-6-2-3-7-14)18-12-10-16(11-13-18)8-4-1-5-9-16/h14H,1-13H2,(H,17,19).
What are the key properties of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide has a molecular weight of 264.41 g/mol, XLogP of 3.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide is sourced from PubChem (CID 115605548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).