About N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide
N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide (PubChem CID 43908262) has the molecular formula C20H23ClN2O2
and a molecular weight of 358.87 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide.
Molecular Properties
| Compound Name | N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide |
| PubChem CID | 43908262 |
| Molecular Formula | C20H23ClN2O2 |
| Molecular Weight | 358.87 g/mol |
| Exact Mass | 358.14 |
| IUPAC Name | N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide |
| SMILES | CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(CN2CCOCC2)cc1 |
| InChI | InChI=1S/C20H23ClN2O2/c1-22(14-16-4-8-19(21)9-5-16)20(24)18-6-2-17(3-7-18)15-23-10-12-25-13-11-23/h2-9H,10-15H2,1H3 |
| InChIKey | IOOPHCSDBMFLCW-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 32.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 358.87 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide (CID 43908262) is N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide is CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(CN2CCOCC2)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide?
The InChIKey is IOOPHCSDBMFLCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-22(14-16-4-8-19(21)9-5-16)20(24)18-6-2-17(3-7-18)15-23-10-12-25-13-11-23/h2-9H,10-15H2,1H3.
What are the key properties of N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide?
N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide has a molecular weight of 358.87 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide is sourced from PubChem (CID 43908262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).