Home Carboxys methyl 1-benzyl-4-cyanopiperidine-4-carboxylate

methyl 1-benzyl-4-cyanopiperidine-4-carboxylate

CAS No.:
1817003-33-0
Catalog Number:
AG01C4C1
Molecular Formula:
C15H18N2O2
Molecular Weight:
258.3156
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Product Description
Catalog Number:
AG01C4C1
Chemical Name:
methyl 1-benzyl-4-cyanopiperidine-4-carboxylate
CAS Number:
1817003-33-0
Molecular Formula:
C15H18N2O2
Molecular Weight:
258.3156
MDL Number:
MFCD29763092
IUPAC Name:
methyl 1-benzyl-4-cyanopiperidine-4-carboxylate
InChI:
InChI=1S/C15H18N2O2/c1-19-14(18)15(12-16)7-9-17(10-8-15)11-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3
InChI Key:
FMLQYZRPYWPTDC-UHFFFAOYSA-N
SMILES:
COC(=O)C1(CCN(CC1)Cc1ccccc1)C#N
Properties
Complexity:
358  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.137g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.321g/mol
Monoisotopic Mass:
258.137g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties