tert-butyl 3-[(dimethylamino)methylene]-4-oxotetrahydro-1(2H)-pyridinecarboxylate

HCID 53395404

基本情報

標準SMILES
CN(C)C=C1CN(C(=O)OC(C)(C)C)CCC1=O
InChIKey
YUSMZDVTEOAHDL-UHFFFAOYSA-N
分子式
C13H22N2O3
平均分子量
254.33 g/mol
単同位体質量
254.16304257

名称と識別子

優先名称
tert-butyl 3-[(dimethylamino)methylene]-4-oxotetrahydro-1(2H)-pyridinecarboxylate
IUPAC
tert-butyl 3-(dimethylaminomethylidene)-4-oxopiperidine-1-carboxylate

名称と別名

157327-41-81-BOC-3-[(DIMETHYLAMINO)METHYLENE]-4-OXOPIPERIDINEMFCD08443986tert-butyl 3-[(dimethylamino)methylene]-4-oxotetrahydro-1(2H)-pyridinecarboxylate3-Dimethylaminomethylene-4-oxo-piperidine-1-carboxylic acid tert-butyl estertert-butyl 3-(dimethylaminomethylidene)-4-oxopiperidine-1-carboxylate1310796-19-01-Boc-3-((Dimethylamino)methylene)-4-oxopiperidinetert-butyl-3-((dimethylamino)methylene)-4-oxopiperidine-1-carboxylatetert-butyl-3-[(dimethylamino)methylene]-4-oxopiperidine-1-carboxylateSCHEMBL785942tert-Butyl 3-((dimethylamino)methylene)-4-oxopiperidine-1-carboxylate
名称をさらに表示
tert-Butyl 3-[(dimethylamino)methylene]-4-oxopiperidine-1-carboxylate1-Piperidinecarboxylic acid, 3-[(dimethylamino)methylene]-4-oxo-, 1,1-dimethylethyl esterTERT-BUTYL (3Z)-3-[(DIMETHYLAMINO)METHYLIDENE]-4-OXOPIPERIDINE-1-CARBOXYLATEYUSMZDVTEOAHDL-UHFFFAOYSA-NAKOS025244025SB33938SY008669DB-064167

データベース識別子

PubChem CID
53395404

物性

構造計算による物性

XLogP
0.8
極性表面積
49.9 Ų
水素結合供与体数
0
水素結合受容体数
4
回転可能結合数
3
重原子数
18

関連反応

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