939986-31-9
3-[(4-METHYL-PYRIDIN-2-YLAMINO)-METHYL]-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Name3-[(4-METHYL-PYRIDIN-2-YLAMINO)-METHYL]-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1Identification
【Name】
3-[(4-METHYL-PYRIDIN-2-YLAMINO)-METHYL]-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD09607558
【English Synonyms】
【Formula】
C17 H27 N3 O2
【MolWeight】
305.419
【Inchi】
InChI=1S/C17H27N3O2/c1-13-7-8-18-15(10-13)19-11-14-6-5-9-20(12-14)16(21)22-17(2,3)4/h7-8,10,14H,5-6,9,11-12H2,1-4H3,(H,18,19)
【InChIKey】
InChIKey=RIMSKQAOZWMYGG-UHFFFAOYSA-N
【SMILES】
Cc1ccnc(c1)NCC2CCCN(C2)C(=O)OC(C)(C)C
【MOL File】
3-[(4-METHYL-PYRIDIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[(4-METHYL-PYRIDIN-2-YLAMINO)-METHYL]-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER.cml