About N-(4-chlorophenyl)cyclopentanecarboxamide
N-(4-chlorophenyl)cyclopentanecarboxamide (PubChem CID 849228) has the molecular formula C12H14ClNO
and a molecular weight of 223.70 g/mol. Its IUPAC name is N-(4-chlorophenyl)cyclopentanecarboxamide.
Molecular Properties
| Compound Name | N-(4-chlorophenyl)cyclopentanecarboxamide |
| PubChem CID | 849228 |
| Molecular Formula | C12H14ClNO |
| Molecular Weight | 223.70 g/mol |
| Exact Mass | 223.08 |
| IUPAC Name | N-(4-chlorophenyl)cyclopentanecarboxamide |
| SMILES | O=C(Nc1ccc(Cl)cc1)C1CCCC1 |
| InChI | InChI=1S/C12H14ClNO/c13-10-5-7-11(8-6-10)14-12(15)9-3-1-2-4-9/h5-9H,1-4H2,(H,14,15) |
| InChIKey | ZJVORKOWFIWCLT-UHFFFAOYSA-N |
| XLogP | 3.47 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 223.70 |
| LogP ≤ 5 | 3.47 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Analyze N-(4-chlorophenyl)cyclopentanecarboxamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of N-(4-chlorophenyl)cyclopentanecarboxamide?
The IUPAC name of N-(4-chlorophenyl)cyclopentanecarboxamide (CID 849228) is N-(4-chlorophenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-chlorophenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-chlorophenyl)cyclopentanecarboxamide is O=C(Nc1ccc(Cl)cc1)C1CCCC1.
What is the InChIKey of N-(4-chlorophenyl)cyclopentanecarboxamide?
The InChIKey is ZJVORKOWFIWCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClNO/c13-10-5-7-11(8-6-10)14-12(15)9-3-1-2-4-9/h5-9H,1-4H2,(H,14,15).
What are the key properties of N-(4-chlorophenyl)cyclopentanecarboxamide?
N-(4-chlorophenyl)cyclopentanecarboxamide has a molecular weight of 223.70 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)cyclopentanecarboxamide is sourced from PubChem (CID 849228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).