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206274-42-2 | 1-Piperidinecarboxylic acid, 4-[(phenylmethyl)amino]-, phenylmethyl ester
CAS No: 206274-42-2 Catalog No: AG002IEK MDL No:MFCD11101363
Product Description
Catalog Number:
AG002IEK
Chemical Name:
1-Piperidinecarboxylic acid, 4-[(phenylmethyl)amino]-, phenylmethyl ester
CAS Number:
206274-42-2
Molecular Formula:
C20H24N2O2
Molecular Weight:
324.4168
MDL Number:
MFCD11101363
IUPAC Name:
benzyl 4-(benzylamino)piperidine-1-carboxylate
InChI:
InChI=1S/C20H24N2O2/c23-20(24-16-18-9-5-2-6-10-18)22-13-11-19(12-14-22)21-15-17-7-3-1-4-8-17/h1-10,19,21H,11-16H2
InChI Key:
WLWMPHXMKPXNSW-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)NCc1ccccc1)OCc1ccccc1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.184g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.424g/mol
Monoisotopic Mass:
324.184g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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