Name: Name:1-Piperidinecarboxylic acid, 4-[(4-pyridinylmethyl)amino]-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG002IEL
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-[(4-pyridinylmethyl)amino]-, 1,1-dimethylethyl ester

CAS No.:

206274-24-0

Catalog Number:

AG002IEL

Molecular Formula:

C16H25N3O2

Molecular Weight:

291.3886

Catalog Number:

AG002IEL

Chemical Name:

1-Piperidinecarboxylic acid, 4-[(4-pyridinylmethyl)amino]-, 1,1-dimethylethyl ester

CAS Number:

206274-24-0

Molecular Formula:

C16H25N3O2

Molecular Weight:

291.3886

MDL Number:

MFCD04114985

IUPAC Name:

tert-butyl 4-(pyridin-4-ylmethylamino)piperidine-1-carboxylate

InChI:

InChI=1S/C16H25N3O2/c1-16(2,3)21-15(20)19-10-6-14(7-11-19)18-12-13-4-8-17-9-5-13/h4-5,8-9,14,18H,6-7,10-12H2,1-3H3

InChI Key:

KVEICFWHRVQJAL-UHFFFAOYSA-N

SMILES:

O=C(N1CCC(CC1)NCc1ccncc1)OC(C)(C)C

Complexity:

327

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.195g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.395g/mol

Monoisotopic Mass:

291.195g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7