tert-Butyl (2-Aminocyclopentyl)carbamate (Mixture of Diastereomers) - CAS 1193388-07-6
Catalog: |
BB056841 |
Product Name: |
tert-Butyl (2-Aminocyclopentyl)carbamate (Mixture of Diastereomers) |
CAS: |
1193388-07-6 |
Synonyms: |
1,1-Dimethylethyl N-(2-aminocyclopentyl)carbamate;N-(2-Aminocyclopentyl)-carbamic Acid 1,1-Dimethylethyl Ester |
IUPAC Name: | tert-butyl N-(2-aminocyclopentyl)carbamate |
Description: | tert-Butyl (2-aminocyclopentyl)carbamate (cas# 1193388-07-6) is used as a reactant in the synthetic preparation of carboxamides as inhibitors of IRAK4 activity. |
Molecular Weight: | 200.27 |
Molecular Formula: | C10H20N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCCC1N |
InChI: | InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-8-6-4-5-7(8)11/h7-8H,4-6,11H2,1-3H3,(H,12,13) |
InChI Key: | PAXDIBGWURAVIH-UHFFFAOYSA-N |
References: | Lim, J., et al. PCT Int. Appl. 80 pp. (2016). |
Complexity: | 211 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.152477885 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 64.4Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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