HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 909921Generated: October 29, 2026
Ethyl Acetate → 3-(3-(1-Allyl-1H-1,2,3-triazol-4-yl)phenethoxy)-N-cyclohexyl-N-(2,2-dimethoxyethyl)propanamide
https://huagongshe.com/reaction/909921
Participants
| Role | Name | HCID | Charge |
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| Reactant | Ethyl Acetate | HCID 8857 | — |
| Reactant | N-(2,2-dimethoxyethyl)cyclohexanamine | HCID 3024915 | — |
| Reactant | tert-Butyl 3-(3-(1-allyl-1H-1,2,3-triazol-4-yl)phenethoxy)propanoate | HCID 59290465 | — |
| Solvent | 2-Methylpentane | HCID 7892 | — |
| Product | 3-(3-(1-Allyl-1H-1,2,3-triazol-4-yl)phenethoxy)-N-cyclohexyl-N-(2,2-dimethoxyethyl)propanamide | HCID 59290481 | — |
Reaction Steps
The subtitled compound (584 mg) was prepared from tert-butyl 3-(3-(1-allyl-1H-1,2,3-triazol-4-yl)phenethoxy)propanoate [Ex 4, Step iii)] and N-(2,2-dimethoxyethyl)cyclohexanamine using a similar method to that described in Example 12, Step iii) the elution gradient 20 to 100% ethyl acetate in isohexane. 1H NMR (400 MHz, CD3OD) δ 8.29 (s, 1H), 7.69 and 7.67 (2 s, 1H), 7.64 (d, J=7.9 Hz, 1H), 7.322 and 7.318 (2×t, J=7.7 Hz, 1H), 7.20 (d, J=6.9 Hz, 1H), 6.17-6.06 (m, 1H), 5.36-5.27 (m, 2H), 5.06 (d, J=5.9 Hz, 2H), 4.52 and 4.36 (2×t, J=5.5 Hz, 1H), 3.99 and 3.65 (tt, J=5.3 and 11.7 Hz, 1H), 3.76-3.66 (m, 4H), 3.34 (s, 3H), 3.32 (s, 3H), 3.34 and 3.25 (2×d, J=4.9 Hz, 2H), 2.92-2.85 (m, 2H), 2.68-2.61 (m, 2H), 1.79-1.02 (m, 10H); a ˜1:1 mixture of rotamers is observed.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08017602B2 |
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| Source dataset | uspto-grants-2011_09 |
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| ORD ID | ord-ce8395a1fc7f4664b9c042df82c0fdd6 |
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| Source note | uspto-grants-2011_09 |
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