Cas no 1354001-80-1 ((S)-tert-Butyl isopropyl(piperidin-3-yl)carbamate)

(S)-tert-Butyl isopropyl(piperidin-3-yl)carbamate structure
1354001-80-1 structure
Product Name:(S)-tert-Butyl isopropyl(piperidin-3-yl)carbamate
CAS No:1354001-80-1
MF:C13H26N2O2
MW:242.357743740082
CID:2091642
PubChem ID:66569342
Update Time:2025-04-21

(S)-tert-Butyl isopropyl(piperidin-3-yl)carbamate Chemical and Physical Properties

Names and Identifiers

    • (S)-tert-Butyl isopropyl(piperidin-3-yl)carbamate
    • Isopropyl-(S)-piperidin-3-yl-carbamic acid tert-butyl ester
    • (S)-tert-Butylisopropyl(piperidin-3-yl)carbamate
    • DB-255024
    • tert-butyl N-[(3S)-piperidin-3-yl]-N-propan-2-ylcarbamate
    • AKOS024463314
    • 1354001-80-1
    • MDL: MFCD21098130
    • Inchi: 1S/C13H26N2O2/c1-10(2)15(11-7-6-8-14-9-11)12(16)17-13(3,4)5/h10-11,14H,6-9H2,1-5H3/t11-/m0/s1
    • InChI Key: DRJBVMBAQADEBT-NSHDSACASA-N
    • SMILES: O(C(C)(C)C)C(N(C(C)C)[C@@H]1CNCCC1)=O

Computed Properties

  • Exact Mass: 242.199428076Da
  • Monoisotopic Mass: 242.199428076Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 259
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 41.6?2

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