2-({2-[(4-Methoxyphenyl)Amino]-4-Pyrimidinyl}Amino)Ethanol

Molecule SVG Image

Properties Simple | Detailed

Formula C13H16N4O2
IUPAC Name 2-[[2-(4-methoxyanilino)pyrimidin-4-yl]amino]ethanol
Molecular Mass 260.292 g·mol−1
Heat of Formation -92.8 ± 16.7 kJ·mol−1
Dipole Moment 3.44 ± 1.08 D
Volume 314.11 Å 3
Surface Area 293.77 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-methoxyanilino)-4-(1-hydroxyethylamino)pyrimidine
  • 2-[[2-[(4-methoxyphenyl)amino]-4-pyrimidinyl]amino]ethanol
  • 2-[[2-[(4-methoxyphenyl)amino]pyrimidin-4-yl]amino]ethanol
  • bcbcmap01_000249
  • cardiogenol c
  • hsci1_000039
InChIKey LKBSMPFEKIBRGC-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N