1-Boc-4-(benzylamino)piperidine - CAS 206273-87-2

Catalog:	BB016113
Product Name:	1-Boc-4-(benzylamino)piperidine
CAS:	206273-87-2
Synonyms:	4-[(phenylmethyl)amino]-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 4-(benzylamino)piperidine-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	tert-butyl 4-(benzylamino)piperidine-1-carboxylate
Description:	1-Boc-4-(benzylamino)piperidine (CAS# 206273-87-2) is a useful research chemical.
Molecular Weight:	290.40
Molecular Formula:	C17H26N2O2
Canonical SMILES:	CC(C)(C)OC(=O)N1CCC(CC1)NCC2=CC=CC=C2
InChI:	InChI=1S/C17H26N2O2/c1-17(2,3)21-16(20)19-11-9-15(10-12-19)18-13-14-7-5-4-6-8-14/h4-8,15,18H,9-13H2,1-3H3
InChI Key:	IUJZIXJMTQNFOG-UHFFFAOYSA-N
Boiling Point:	398.115 °C at 760 mmHg
Density:	1.076 g/cm³
LogP:	3.50450

Publication Number	Title	Priority Date
WO-2021206876-A1	Inhibitors of norovirus and coronavirus replication	20200410
CN-108503579-B	Fentanyl analogs and uses thereof	20180328
AU-2016324483-A1	Methods and compositions of inhibiting DCN1-UBC12 interaction	20150918
CA-2998753-A1	Methods and compositions of inhibiting dcn1-ubc12 interaction	20150918
EP-3349743-A1	Methods and compositions of inhibiting dcn1-ubc12 interaction	20150918

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Complexity:	324
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	290.199428076
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	290.199428076
Rotatable Bond Count:	5
Topological Polar Surface Area:	41.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7