About 2-(3-chloro-5-methylphenyl)morpholine
2-(3-chloro-5-methylphenyl)morpholine (PubChem CID 83703313) has the molecular formula C11H14ClNO
and a molecular weight of 211.69 g/mol. Its IUPAC name is 2-(3-chloro-5-methylphenyl)morpholine.
Molecular Properties
| Compound Name | 2-(3-chloro-5-methylphenyl)morpholine |
| PubChem CID | 83703313 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.69 g/mol |
| Exact Mass | 211.08 |
| IUPAC Name | 2-(3-chloro-5-methylphenyl)morpholine |
| SMILES | Cc1cc(Cl)cc(C2CNCCO2)c1 |
| InChI | InChI=1S/C11H14ClNO/c1-8-4-9(6-10(12)5-8)11-7-13-2-3-14-11/h4-6,11,13H,2-3,7H2,1H3 |
| InChIKey | LSTGLROKQIWNBC-UHFFFAOYSA-N |
| XLogP | 2.31 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 211.69 |
| LogP ≤ 5 | 2.31 |
| 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-chloro-5-methylphenyl)morpholine?
The IUPAC name of 2-(3-chloro-5-methylphenyl)morpholine (CID 83703313) is 2-(3-chloro-5-methylphenyl)morpholine.
What is the SMILES notation for 2-(3-chloro-5-methylphenyl)morpholine?
The canonical SMILES for 2-(3-chloro-5-methylphenyl)morpholine is Cc1cc(Cl)cc(C2CNCCO2)c1.
What is the InChIKey of 2-(3-chloro-5-methylphenyl)morpholine?
The InChIKey is LSTGLROKQIWNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-8-4-9(6-10(12)5-8)11-7-13-2-3-14-11/h4-6,11,13H,2-3,7H2,1H3.
What are the key properties of 2-(3-chloro-5-methylphenyl)morpholine?
2-(3-chloro-5-methylphenyl)morpholine has a molecular weight of 211.69 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-5-methylphenyl)morpholine is sourced from PubChem (CID 83703313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).