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Home> Encyclopedia > Hot Product Listed 5   > 5-Pyrimidinecarboxamide,2-amino-N-(1-ethyl-3-piperidinyl)-4-methoxy-
20620-59-1 structure

5-Pyrimidinecarboxamide,2-amino-N-(1-ethyl-3-piperidinyl)-4-methoxy-

Iupac Name:methyl 5-phenylpentanoate
CAS No.:20620-59-1
Molecular Weight:192.258
Molecular Formula:C13H28O (isomer)
Names and Identifiers
Synonyms

2-amino-n- -4-methoxy-5-pyrimidinecarboxamide 2-amino-n-(1-ethyl-3-piperidinyl)-4-methoxy-5-pyrimidinecarboxamide 2-amino-n-(1-ethyl-3-piperidyl)-4-methoxy-5-pyrimidinecarboxamide 2-amino-n-(1-ethyl-piperidin-3-yl)-4-methoxy-5-pyrimidinecarboxamide 2-amino-n-(1-ethylpiperidin-3-yl)-4-methoxypyrimidine-5-carb 2-amino-n-(1-ethylpiperidin-3-yl)-4-methoxypyrimidine-5-carboxamide 5-pyrimidinecarboxamide, 2-amino-n-(1-ethyl-3-piperidyl)-4-methoxy- AC1MIH59 AKOS030557002 brn 5567775 HE187691 KB-283147 LS-134738

Inchi
InChI=1S/C12H16O2/c1-14-12(13)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3
InChkey
BNNWLDUOVGYRLY-UHFFFAOYSA-N
Canonical Smiles
COC(=O)CCCCC1=CC=CC=C1
Properties
Density
1.46
Boiling Point
°Cat760mmHg
Vapour
0.00659mmHg at 25°C
Refractive Index
1.496
Flash Point
284.8°C
Computational chemical data
  • Molecular Weight:192.258g/mol
  • Molecular Formula:C13H28O
  • Compound Is Canonicalized:True
  • XLogP3-AA:3
  • Exact Mass:192.115
  • Monoisotopic Mass:192.115
  • Complexity:160
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:26.3A^2
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceBwMAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGgAAAAAADACAmAIyCIAABACI AiDSCAACAAAgAAAIiAEAAIgIIDKAERCAIAAkgAAIiAeIyOCOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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