About 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide
2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide (PubChem CID 3240085) has the molecular formula C19H26ClN3O2
and a molecular weight of 363.89 g/mol. Its IUPAC name is 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide.
Molecular Properties
| Compound Name | 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide |
| PubChem CID | 3240085 |
| Molecular Formula | C19H26ClN3O2 |
| Molecular Weight | 363.89 g/mol |
| Exact Mass | 363.17 |
| IUPAC Name | 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide |
| SMILES | O=C(CN1CCN(Cc2ccccc2Cl)C1=O)NC1CCCCCC1 |
| InChI | InChI=1S/C19H26ClN3O2/c20-17-10-6-5-7-15(17)13-22-11-12-23(19(22)25)14-18(24)21-16-8-3-1-2-4-9-16/h5-7,10,16H,1-4,8-9,11-14H2,(H,21,24) |
| InChIKey | BXWCSOZBXHGZIF-UHFFFAOYSA-N |
| XLogP | 3.42 |
| TPSA | 52.65 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 363.89 |
| LogP ≤ 5 | 3.42 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide?
The IUPAC name of 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide (CID 3240085) is 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide.
What is the SMILES notation for 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide?
The canonical SMILES for 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide is O=C(CN1CCN(Cc2ccccc2Cl)C1=O)NC1CCCCCC1.
What is the InChIKey of 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide?
The InChIKey is BXWCSOZBXHGZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClN3O2/c20-17-10-6-5-7-15(17)13-22-11-12-23(19(22)25)14-18(24)21-16-8-3-1-2-4-9-16/h5-7,10,16H,1-4,8-9,11-14H2,(H,21,24).
What are the key properties of 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide?
2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide has a molecular weight of 363.89 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(2-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-cycloheptylacetamide is sourced from PubChem (CID 3240085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).