904817-40-9
6-[2-(PYRIDIN-4-YL)PYRROLIDIN-1-YL]PYRIDINE-3-CARBOXYLIC ACID
Name6-[2-(PYRIDIN-4-YL)PYRROLIDIN-1-YL]PYRIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
6-[2-(PYRIDIN-4-YL)PYRROLIDIN-1-YL]PYRIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD06245474
【English Synonyms】
【Formula】
C15 H15 N3 O2
【MolWeight】
269.302
【Inchi】
InChI=1S/C15H15N3O2/c19-15(20)12-3-4-14(17-10-12)18-9-1-2-13(18)11-5-7-16-8-6-11/h3-8,10,13H,1-2,9H2,(H,19,20)
【InChIKey】
InChIKey=JXKJIGQBYJMPKA-UHFFFAOYSA-N
【SMILES】
c1cc(ncc1C(=O)O)N2CCCC2c3ccncc3
【MOL File】
6-[2-(PYRIDIN-4-YL)P….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-[2-(PYRIDIN-4-YL)PYRROLIDIN-1-YL]PYRIDINE-3-CARBOXYLIC ACID.cml