893567-09-4 Purity
96%
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The molecular formula of the compound is C16H25BN2O2.
The molecular weight of the compound is 288.2 g/mol.
The IUPAC name of the compound is N-cyclopentyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine.
The InChI of the compound is InChI=1S/C16H25BN2O2/c1-15(2)16(3,4)21-17(20-15)13-10-7-11-14(19-13)18-12-8-5-6-9-12/h7,10-12H,5-6,8-9H2,1-4H3,(H,18,19).
The InChIKey of the compound is FJYXHAJSEWJCPX-UHFFFAOYSA-N.
The canonical SMILES of the compound is B1(OC(C(O1)(C)C)(C)C)C2=NC(=CC=C2)NC3CCCC3.
The CAS number of the compound is 1310404-92-2.
The compound has 1 hydrogen bond donor count.
The compound has 4 hydrogen bond acceptor counts.
The compound has 3 rotatable bond counts.