780745-30-4
5H-PYRROLO[3,4-B]PYRIDIN-5-ONE, 6,7-DIHYDRO-6-(4-PIPERIDINYLMETHYL)-
Name5H-PYRROLO[3,4-B]PYRIDIN-5-ONE, 6,7-DIHYDRO-6-(4-PIPERIDINYLMETHYL)-
1Identification
【Name】
5H-PYRROLO[3,4-B]PYRIDIN-5-ONE, 6,7-DIHYDRO-6-(4-PIPERIDINYLMETHYL)-
【CAS】
【MDL】
MFCD13183617
【English Synonyms】
【Formula】
C13 H17 N3 O
【MolWeight】
231.297
【Inchi】
InChI=1S/C13H17N3O/c17-13-11-2-1-5-15-12(11)9-16(13)8-10-3-6-14-7-4-10/h1-2,5,10,14H,3-4,6-9H2
【InChIKey】
InChIKey=IWNQMAVIESPSCW-UHFFFAOYSA-N
【SMILES】
c1cc2c(nc1)CN(C2=O)CC3CCNCC3
【MOL File】
5H-PYRROLO[3,4-B]PYR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5H-PYRROLO[3,4-B]PYRIDIN-5-ONE, 6,7-DIHYDRO-6-(4-PIPERIDINYLMETHYL)-.cml