1-Boc-2-(N-hydroxycarbamimidoyl)pyrrolidine - CAS 500024-95-3
Catalog: |
BB026883 |
Product Name: |
1-Boc-2-(N-hydroxycarbamimidoyl)pyrrolidine |
CAS: |
500024-95-3 |
Synonyms: |
2-[(Z)-amino(hydroxyimino)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl 2-[(Z)-N'-hydroxycarbamimidoyl]pyrrolidine-1-carboxylate |
IUPAC Name: | tert-butyl 2-[(Z)-N'-hydroxycarbamimidoyl]pyrrolidine-1-carboxylate |
Description: | 1-Boc-2-(N-hydroxycarbamimidoyl)pyrrolidine (CAS# 500024-95-3) is a useful research chemical. |
Molecular Weight: | 229.28 |
Molecular Formula: | C10H19N3O3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC1C(=NO)N |
InChI: | InChI=1S/C10H19N3O3/c1-10(2,3)16-9(14)13-6-4-5-7(13)8(11)12-15/h7,15H,4-6H2,1-3H3,(H2,11,12) |
InChI Key: | NUMIITGLIZNJIC-UHFFFAOYSA-N |
LogP: | 1.77050 |
Publication Number | Title | Priority Date |
WO-2017163078-A1 | 1-cyano-pyrrolidine derivatives as dbu inhibitors | 20160324 |
US-2020331888-A1 | 1-cyano-pyrrolidine derivatives as dub inhibitors | 20160324 |
EP-1441734-B1 | Dihydroxypyrimidine carboxamide inhibitors of hiv integrase | 20011026 |
US-2005025774-A1 | N-substituted hydroxypyrimidinone carboxamide inhibitors of hiv integrase | 20011026 |
US-2005075356-A1 | Dihydroxypyrimidine carboxamide inhibitors of hiv integrase | 20011026 |
Complexity: | 296 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 229.14264148 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.14264148 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 88.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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