Tert-butyl 1-(aminomethyl)-5-fluoro-3-azabicyclo[3.1.1]heptane-3-carboxylate
Structure Info
- Chemspace ID
- CSSB00160469044 (In-Stock Building Blocks)
- CAS
- 2402831-08-5
- MFCD
- MFCD32219674, MFCD32219674
- IUPAC Name
- tert-butyl 1-(aminomethyl)-5-fluoro-3-azabicyclo[3.1.1]heptane-3-carboxylate
- Mol formula
- C12H21FN2O2
- Mol weight
- 244 Da
- Catalog Number(s)
- BB4LS-EN300-7466089, BBLS00160469044, BBV-200485128, BD01315937, BM48735, CSC160469044, EN300-7466089, Y3122301, ZXC417394, bbls00160469044
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.56
- Heavy atoms count
- 17
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.91666666666667
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
![Chemical structure of Tert-butyl 1-(aminomethyl)-5-fluoro-3-azabicyclo[3.1.1]heptane-3-carboxylate (C12H21FN2O2) - CSSB00160469044](/st/structure/200/53b0fd8606783abe235db1678cefb030/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528F%2529CC%2528CN%2529%2528C2%2529C1.png "C12H21FN2O2")
- Zoom the structure
- CSSB00160469044
Items Overall 20 items from 4 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 318.42 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 439.85 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 596.81 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 705.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 850.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 600.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 783.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 1,118.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 1,760.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 2,257.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 600.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 783.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 1,118.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 1,760.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 2,257.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 318.42 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 439.85 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 596.81 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 705.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 850.00 |
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Substructure Analogs
![Chemical structure of tert-butyl (1r,5r)-1-(aminomethyl)-5-fluoro-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB06441478430](/st/structure/200/69ccb0633d8e92f64157edc450cecbce/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%255D2%2528F%2529C%255BC%2540%2540%255D%2528CN%2529%2528C2%2529C1.png)
![Chemical structure of tert-butyl 1-carbamoyl-5-fluoro-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB02270739504](/st/structure/200/b64a409bf1967ef94a7f9a7216bf491e/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528F%2529CC%2528C2%2529%2528C1%2529C%2528N%2529%253DO.png)
![Chemical structure of tert-butyl 1-fluoro-5-(methylcarbamoyl)-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB02283621411](/st/structure/200/9ae4ac0627f1a5ccca83045bf314d23d/CNC%2528%253DO%2529C12CC%2528F%2529%2528C1%2529CN%2528C2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of tert-butyl 1-(dimethylcarbamoyl)-5-fluoro-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB01432921256](/st/structure/200/32e2e72f721a83d103874734e1ec0496/CN%2528C%2529C%2528%253DO%2529C12CC%2528F%2529%2528C1%2529CN%2528C2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of tert-butyl 1-fluoro-5-[methoxy(methyl)carbamoyl]-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB01395049934](/st/structure/200/cd276c112f70e3d13784149d7c6bf0b0/CON%2528C%2529C%2528%253DO%2529C12CC%2528F%2529%2528C1%2529CN%2528C2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
Similarity Analogs
![Chemical structure of tert-butyl 6-(aminomethyl)-6-fluoro-2-azaspiro[3.3]heptane-2-carboxylate - CSSB06744479464](/st/structure/200/7449500c4eaa79ead9bf7ff7d396cf2e/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528C1%2529CC%2528F%2529%2528CN%2529C2.png)
![Chemical structure of tert-butyl 1-fluoro-5-(hydroxymethyl)-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB00161001383](/st/structure/200/fbf1d5e9e2ea854efcf7850d08f85467/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528F%2529CC%2528CO%2529%2528C2%2529C1.png)
![Chemical structure of tert-butyl (1r,5r)-1-(aminomethyl)-5-(hydroxymethyl)-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB20680312771](/st/structure/200/73ddf1e370cc124c269ed279cd3c9c3f/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%255D2%2528CN%2529C%255BC%2540%2540%255D%2528CO%2529%2528C2%2529C1.png)
![Chemical structure of tert-butyl 1-(aminomethyl)-5-(hydroxymethyl)-3-azabicyclo[3.1.1]heptane-3-carboxylate - CSSB20529678632](/st/structure/200/484dd435ad00b1ce1ce6f7560ba8ca34/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528CN%2529CC%2528CO%2529%2528C2%2529C1.png)
