About (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine
(3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine (PubChem CID 170219937) has the molecular formula C10H21NO
and a molecular weight of 171.28 g/mol. Its IUPAC name is (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine.
Molecular Properties
| Compound Name | (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine |
| PubChem CID | 170219937 |
| Molecular Formula | C10H21NO |
| Molecular Weight | 171.28 g/mol |
| Exact Mass | 171.16 |
| IUPAC Name | (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine |
| SMILES | CCC(C)(C)N1CCOC[C@H]1C |
| InChI | InChI=1S/C10H21NO/c1-5-10(3,4)11-6-7-12-8-9(11)2/h9H,5-8H2,1-4H3/t9-/m1/s1 |
| InChIKey | HPABRZAYAPRTKR-SECBINFHSA-N |
| XLogP | 1.90 |
| TPSA | 12.47 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 171.28 |
| LogP ≤ 5 | 1.90 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine?
The IUPAC name of (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine (CID 170219937) is (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine.
What is the SMILES notation for (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine?
The canonical SMILES for (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine is CCC(C)(C)N1CCOC[C@H]1C.
What is the InChIKey of (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine?
The InChIKey is HPABRZAYAPRTKR-SECBINFHSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-10(3,4)11-6-7-12-8-9(11)2/h9H,5-8H2,1-4H3/t9-/m1/s1.
What are the key properties of (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine?
(3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine has a molecular weight of 171.28 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine is sourced from PubChem (CID 170219937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).