About bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine
bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine (PubChem CID 159411301) has the molecular formula C65H126F12N8O7
and a molecular weight of 1359.75 g/mol. Its IUPAC name is bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine.
Molecular Properties
| Compound Name | bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine |
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| PubChem CID | 159411301 |
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| Molecular Formula | C65H126F12N8O7 |
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| Molecular Weight | 1359.75 g/mol |
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| Exact Mass | 1358.96 |
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| IUPAC Name | bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine |
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| SMILES | CC(C)N1CCCC[C@@H]1C(F)(F)F.CC(C)N1CCOC[C@@H]1C(F)(F)F.CC(C)N1CCOC[C@H]1C(F)(F)F.CC(C)N1CCOC[C@H]1C(F)(F)F.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1.CC(C)N1CCO[C@H](C)C1 |
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| InChI | InChI=1S/C9H16F3N.3C8H14F3NO.4C8H17NO/c1-7(2)13-6-4-3-5-8(13)9(10,11)12;3*1-6(2)12-3-4-13-5-7(12)8(9,10)11;4*1-7(2)9-4-5-10-8(3)6-9/h7-8H,3-6H2,1-2H3;3*6-7H,3-5H2,1-2H3;4*7-8H,4-6H2,1-3H3/t8-;3*7-;4*8-/m11001100/s1 |
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| InChIKey | LOPNEHWYAWERJY-CHIVDDEASA-N |
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| XLogP | 12.25 |
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| TPSA | 90.53 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 15 |
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| Rotatable Bonds | 8 |
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| Heavy Atoms | 92 |
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| Complexity | — |
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Lipinski Rule of Five
3 violations
| Rule | Value |
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| MW ≤ 500 | 1359.75 |
| LogP ≤ 5 | 12.25 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |
Analyze bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine with MolForge
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Frequently Asked Questions
What is the IUPAC name of bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine?
The IUPAC name of bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine (CID 159411301) is bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine.
What is the SMILES notation for bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine?
The canonical SMILES for bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine is CC(C)N1CCCC[C@@H]1C(F)(F)F.CC(C)N1CCOC[C@@H]1C(F)(F)F.CC(C)N1CCOC[C@H]1C(F)(F)F.CC(C)N1CCOC[C@H]1C(F)(F)F.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1.CC(C)N1CCO[C@H](C)C1.
What is the InChIKey of bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine?
The InChIKey is LOPNEHWYAWERJY-CHIVDDEASA-N. The full InChI is InChI=1S/C9H16F3N.3C8H14F3NO.4C8H17NO/c1-7(2)13-6-4-3-5-8(13)9(10,11)12;3*1-6(2)12-3-4-13-5-7(12)8(9,10)11;4*1-7(2)9-4-5-10-8(3)6-9/h7-8H,3-6H2,1-2H3;3*6-7H,3-5H2,1-2H3;4*7-8H,4-6H2,1-3H3/t8-;3*7-;4*8-/m11001100/s1.
What are the key properties of bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine?
bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine has a molecular weight of 1359.75 g/mol, XLogP of 12.25, 8 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for bis((2R)-2-methyl-4-propan-2-ylmorpholine);bis((2S)-2-methyl-4-propan-2-ylmorpholine);(3R)-4-propan-2-yl-3-(trifluoromethyl)morpholine;bis((3S)-4-propan-2-yl-3-(trifluoromethyl)morpholine);(2R)-1-propan-2-yl-2-(trifluoromethyl)piperidine is sourced from PubChem (CID 159411301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).