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Home > Pyridines > 1152424-96-8
1152424-96-8 | tert-Butyl 1-(pyridin-4-ylmethyl)piperidin-4-ylcarbamate
CAS No: 1152424-96-8 Catalog No: AG01F7EU MDL No:
Product Description
Catalog Number:
AG01F7EU
Chemical Name:
tert-Butyl 1-(pyridin-4-ylmethyl)piperidin-4-ylcarbamate
CAS Number:
1152424-96-8
Molecular Formula:
C16H25N3O2
Molecular Weight:
291.3886
IUPAC Name:
tert-butyl N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]carbamate
InChI:
InChI=1S/C16H25N3O2/c1-16(2,3)21-15(20)18-14-6-10-19(11-7-14)12-13-4-8-17-9-5-13/h4-5,8-9,14H,6-7,10-12H2,1-3H3,(H,18,20)
InChI Key:
CMMQYMDKULOWNG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCN(CC1)Cc1ccncc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.195g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.395g/mol
Monoisotopic Mass:
291.195g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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