Home Carboxys 1-Piperidinecarboxylic acid,4-(1,5,6,7-tetrahydro-1,8-naphthyridin-2-yl)-, 1,1-dimethylethyl ester

1-Piperidinecarboxylic acid,4-(1,5,6,7-tetrahydro-1,8-naphthyridin-2-yl)-, 1,1-dimethylethyl ester

CAS No.:
206989-63-1
Catalog Number:
AG00I3YN
Molecular Formula:
C18H27N3O2
Molecular Weight:
317.4259
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Product Description
Catalog Number:
AG00I3YN
Chemical Name:
1-Piperidinecarboxylic acid,4-(1,5,6,7-tetrahydro-1,8-naphthyridin-2-yl)-, 1,1-dimethylethyl ester
CAS Number:
206989-63-1
Molecular Formula:
C18H27N3O2
Molecular Weight:
317.4259
MDL Number:
MFCD22690539
IUPAC Name:
tert-butyl 4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)piperidine-1-carboxylate
InChI:
InChI=1S/C18H27N3O2/c1-18(2,3)23-17(22)21-11-8-13(9-12-21)15-7-6-14-5-4-10-19-16(14)20-15/h6-7,13H,4-5,8-12H2,1-3H3,(H,19,20)
InChI Key:
ZVYMXHCYHZCTNG-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)c1ccc2c(n1)NCCC2)OC(C)(C)C
Properties
Complexity:
413  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.21g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
317.433g/mol
Monoisotopic Mass:
317.21g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties