Synonyms
CHEMBL1829683;SCHEMBL13946518;MFCD26033209;ZINC72114791;268556-62-3;(2R)-2-Amino-3,3-dimethyl-N-(phenylmethyl)butanamide, 98%, (99% ee);
IUPAC Name
(2R)-2-amino-N-benzyl-3,3-dimethylbutanamide;
Molecular Weight
220.316g/mol
Molecular Formula
C13H20N2O;
Canonical SMILES
CC(C)(C)C(C(=O)NCC1=CC=CC=C1)N;
InChI
InChI=1S/C13H20N2O/c1-13(2,3)11(14)12(16)15-9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3,(H,15,16)/t11-/m0/s1;
InChI Key
VCKOJWNPRZBZKV-NSHDSACASA-N;
Complexity
227
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
1
Exact Mass
220.158g/mol
H-Bond Acceptor
2
H-Bond Donor
2
Heavy Atom Count
16
Monoisotopic Mass
220.158g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
55.1A^2
