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1002359-85-4 | 1-Piperidinecarboxylic acid, 3-[(aminocarbonyl)amino]-, 1,1-dimethylethyl ester, (3R)-
CAS No: 1002359-85-4 Catalog No: AG0001BD MDL No:
Product Description
Catalog Number:
AG0001BD
Chemical Name:
1-Piperidinecarboxylic acid, 3-[(aminocarbonyl)amino]-, 1,1-dimethylethyl ester, (3R)-
CAS Number:
1002359-85-4
Molecular Formula:
C11H21N3O3
Molecular Weight:
243.3027
IUPAC Name:
tert-butyl (3R)-3-(carbamoylamino)piperidine-1-carboxylate
InChI:
InChI=1S/C11H21N3O3/c1-11(2,3)17-10(16)14-6-4-5-8(7-14)13-9(12)15/h8H,4-7H2,1-3H3,(H3,12,13,15)/t8-/m1/s1
InChI Key:
QEPWCXCCZBAVLY-MRVPVSSYSA-N
SMILES:
NC(=O)N[C@@H]1CCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
243.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.307g/mol
Monoisotopic Mass:
243.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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