tert-butyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate - CAS 1031927-12-4
Catalog: |
BB001039 |
Product Name: |
tert-butyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate |
CAS: |
1031927-12-4 |
Synonyms: |
2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylic acid tert-butyl ester; tert-butyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate |
IUPAC Name: | tert-butyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate |
Description: | tert-butyl 2-oxo-1,9-diazaspiro[5.5]undecane-9-carboxylate (CAS# 1031927-12-4) is a useful research chemical. |
Molecular Weight: | 268.357 |
Molecular Formula: | C14H24N2O3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2(CCCC(=O)N2)CC1 |
InChI: | InChI=1S/C14H24N2O3/c1-13(2,3)19-12(18)16-9-7-14(8-10-16)6-4-5-11(17)15-14/h4-10H2,1-3H3,(H,15,17) |
InChI Key: | DMVDIODCUUAZDO-UHFFFAOYSA-N |
MDL: | MFCD09998742 |
LogP: | 2.32290 |
Publication Number | Title | Priority Date |
EP-2632924-A1 | Diaza-spiro[5.5]undecanes useful as orexin receptor antagonists | 20101026 |
JP-2013540792-A | Diaza-spiro [5.5] undecanes useful as orexin receptor antagonists | 20101026 |
US-2012101110-A1 | Diaza-spiro[5.5]undecanes | 20101026 |
US-2013281463-A1 | Diaza-spiro[5.5]undecanes useful as orexin receptor antagonists | 20101026 |
WO-2012055888-A1 | Diaza-spiro[5.5]undecanes useful as orexin receptor antagonists | 20101026 |
Complexity: | 365 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.17869263 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.17869263 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 58.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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