6-[5-({(3R,4R)-4-[(6-Amino-4-Methyl-2-Pyridinyl)Methyl]-3-Pyrrolidinyl}Oxy)Pentyl]-4-Methyl-2-Pyridinamine

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Properties Simple | Detailed

Formula C22H33N5O
IUPAC Name 6-[5-[(3r,4r)-4-[(6-amino-4-methyl-2-pyridyl)methyl]pyrrolidin-3-yl]oxypentyl]-4-methyl-pyridin-2-amine
Molecular Mass 383.530 g·mol−1
Heat of Formation -118.7 ± 16.7 kJ·mol−1
Dipole Moment 2.54 ± 1.08 D
Volume 501.4 Å 3
Surface Area 454.77 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
InChIKey WKAYHKZPKWNKSL-XLIONFOSSA-N
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