1-(Piperidin-3-ylmethyl)pyrrolidin-2-one - CAS 876709-32-9
Catalog: |
BB038577 |
Product Name: |
1-(Piperidin-3-ylmethyl)pyrrolidin-2-one |
CAS: |
876709-32-9 |
Synonyms: |
1-(piperidin-3-ylmethyl)pyrrolidin-2-one |
IUPAC Name: | 1-(piperidin-3-ylmethyl)pyrrolidin-2-one |
Description: | 1-(Piperidin-3-ylmethyl)pyrrolidin-2-one (CAS# 876709-32-9) is a useful research chemical. |
Molecular Weight: | 182.26 |
Molecular Formula: | C10H18N2O |
Canonical SMILES: | C1CC(CNC1)CN2CCCC2=O |
InChI: | InChI=1S/C10H18N2O/c13-10-4-2-6-12(10)8-9-3-1-5-11-7-9/h9,11H,1-8H2 |
InChI Key: | PNQLQOFVZKTDSF-UHFFFAOYSA-N |
Boiling Point: | 334.2 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.057 g/cm3 |
MDL: | MFCD06408761 |
LogP: | 0.87510 |
Publication Number | Title | Priority Date |
EP-2822941-B1 | Benzodioxanes in combination with statins for inhibiting leukotriene production | 20120306 |
US-9662339-B2 | Benzodioxane inhibitors of leukotriene production for combination therapy | 20120306 |
WO-2012125598-A1 | Benzodioxane inhibitors of leukotriene production | 20110314 |
AU-2011347711-A1 | Indazolyl triazole derivatives as IRAK inhibitors | 20101220 |
AU-2011347711-B2 | Indazolyl triazole derivatives as IRAK inhibitors | 20101220 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.141913202 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.141913202 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 32.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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Pyrrolidines
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