- Benzoxazepines as inhibitors of PI3K/mTOR and methods of their use as antitumor agents and manufacture, World Intellectual Property Organization, , ,
Cas no 948988-53-2 (4-methylpiperidine-4-carbonitrile)
4-Methylpiperidine-4-carbonitrile is a versatile nitrile-functionalized piperidine derivative used as a key intermediate in organic synthesis and pharmaceutical research. Its rigid piperidine scaffold, combined with the reactive nitrile group, enables diverse chemical transformations, including cyclizations, reductions, and nucleophilic additions. The methyl substitution at the 4-position enhances steric and electronic properties, making it valuable for modulating molecular interactions in drug design. This compound is particularly useful in the development of bioactive molecules, such as CNS agents and enzyme inhibitors, due to its balanced lipophilicity and structural flexibility. High purity grades ensure consistent performance in synthetic applications.
948988-53-2 structure
Product Name:4-methylpiperidine-4-carbonitrile
CAS No:948988-53-2
MF:C7H12N2
MW:124.183581352234
MDL:MFCD13176183
CID:2144121
PubChem ID:20711133
Update Time:2025-06-09
4-methylpiperidine-4-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4-methylpiperidine-4-carbonitrile
- VIXYONLJAGTTOD-UHFFFAOYSA-N
- DB-358459
- 948988-53-2
- AKOS022180021
- CS-0183566
- SB42570
- MFCD13176183
- SCHEMBL2223641
- EN300-150664
- 4-METHYL-4-PIPERIDINECARBONITRILE
- CHEMBL4580781
- DTXSID00609451
-
- MDL： MFCD13176183
- Inchi： 1S/C7H12N2/c1-7(6-8)2-4-9-5-3-7/h9H,2-5H2,1H3
- InChI Key： VIXYONLJAGTTOD-UHFFFAOYSA-N
- SMILES： N1CCC(C#N)(C)CC1
Computed Properties
- Exact Mass: 124.100048391Da
- Monoisotopic Mass: 124.100048391Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 136
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 35.8?2
4-methylpiperidine-4-carbonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M725940-10mg |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | 10mg |
$ 50.00 | 2022-06-03 | ||
| TRC | M725940-50mg |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | 50mg |
$ 115.00 | 2022-06-03 | ||
| TRC | M725940-100mg |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | 100mg |
$ 185.00 | 2022-06-03 | ||
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1254236-50mg |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | 98% | 50mg |
￥1848.00 | 2024-04-24 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1254236-100mg |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | 98% | 100mg |
￥3675.00 | 2024-04-24 | |
| A2B Chem LLC | AI90234-1g |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | > 95% | 1g |
$398.00 | 2024-07-18 | |
| A2B Chem LLC | AI90234-3g |
4-Methylpiperidine-4-carbonitrile |
948988-53-2 | > 95% | 3g |
$868.00 | 2024-07-18 | |
| Enamine | EN300-150664-0.05g |
4-methylpiperidine-4-carbonitrile |
948988-53-2 | 0.05g |
$128.0 | 2023-02-14 | ||
| Enamine | EN300-150664-0.1g |
4-methylpiperidine-4-carbonitrile |
948988-53-2 | 0.1g |
$134.0 | 2023-02-14 | ||
| Enamine | EN300-150664-0.25g |
4-methylpiperidine-4-carbonitrile |
948988-53-2 | 0.25g |
$140.0 | 2023-02-14 |
4-methylpiperidine-4-carbonitrile Production Method
Production Method 1
Reaction Conditions
1.1 Reagents: Hydrochloric acid Solvents: Acetonitrile , 1,4-Dioxane ; 15 min, 70 °C
Reference
4-methylpiperidine-4-carbonitrile Raw materials
4-methylpiperidine-4-carbonitrile Preparation Products
4-methylpiperidine-4-carbonitrile Related Literature
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
948988-53-2 (4-methylpiperidine-4-carbonitrile) Related Products
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- 203662-67-3(7-azaspiro[3.5]nonane-2-carbonitrile)
- 4395-98-6(Piperidine-4-carbonitrile)
- 256411-45-7(4-Piperidineacetonitrile, alpha-methyl-)
- 26458-78-6(4-Cyanoquinuclidine)
- 20691-92-3(1-methylpiperidine-4-carbonitrile)
- 62718-35-8(4-Piperidinecarbonitrile, 1,4-dimethyl-, hydrochloride (1:1))
- 62718-29-0(4-Piperidinecarbonitrile, 1,4-dimethyl-)
- 88654-16-4(4-Piperidinecarbonitrile, 1-ethyl-)
- 948894-26-6(4-Methylpiperidine-4-carbonitrile hydrochloride)
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