Cas no 637038-98-3 (3-Pyrrolidinol, 3-[[(2-hydroxyethyl)amino]methyl]-1-(phenylmethyl)-)

3-Pyrrolidinol, 3-[[(2-hydroxyethyl)amino]methyl]-1-(phenylmethyl)- structure
637038-98-3 structure
Product Name:3-Pyrrolidinol, 3-[[(2-hydroxyethyl)amino]methyl]-1-(phenylmethyl)-
CAS No:637038-98-3
MF:C14H22N2O2
MW:250.336683750153
CID:425910
PubChem ID:21983514
Update Time:2025-04-19

3-Pyrrolidinol, 3-[[(2-hydroxyethyl)amino]methyl]-1-(phenylmethyl)- Chemical and Physical Properties

Names and Identifiers

    • 3-Pyrrolidinol, 3-[[(2-hydroxyethyl)amino]methyl]-1-(phenylmethyl)-
    • 1-benzyl-3-[(2-hydroxyethylamino)methyl]pyrrolidin-3-ol
    • 1-benzyl-3-hydroxy-3-(2-hydroxyethylaminomethyl)pyrrolidine
    • 1-Benzyl-3-(((2-hydroxyethyl)amino)methyl)pyrrolidin-3-ol
    • 637038-98-3
    • 1-BENZYL-3-{[(2-HYDROXYETHYL)AMINO]METHYL}PYRROLIDIN-3-OL
    • DTXSID70621160
    • JITKBBMAWUZSLT-UHFFFAOYSA-N
    • SCHEMBL3368028
    • 1-benzyl-3-hydroxy-3-(2-hydroxyethylaminomethyl)-pyrrolidine
    • Inchi： 1S/C14H22N2O2/c17-9-7-15-11-14(18)6-8-16(12-14)10-13-4-2-1-3-5-13/h1-5,15,17-18H,6-12H2
    • InChI Key： JITKBBMAWUZSLT-UHFFFAOYSA-N
    • SMILES： OC1(CNCCO)CN(CC2C=CC=CC=2)CC1

Computed Properties

  • Exact Mass: 250.16826
  • Monoisotopic Mass: 250.168127949g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 6
  • Complexity: 244
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 55.7?2

Experimental Properties

  • PSA: 55.73

3-Pyrrolidinol, 3-[[(2-hydroxyethyl)amino]methyl]-1-(phenylmethyl)- Related Literature

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