trans-3-(Boc-amino)-4-fluoropiperidine - CAS 1052713-46-8

Catalog:	BB001595
Product Name:	trans-3-(Boc-amino)-4-fluoropiperidine
CAS:	1052713-46-8
Synonyms:	N-[(3R,4R)-4-fluoro-3-piperidinyl]carbamic acid tert-butyl ester; tert-butyl N-[(3R,4R)-4-fluoropiperidin-3-yl]carbamate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl N-[(3R,4R)-4-fluoropiperidin-3-yl]carbamate
Description:	trans-3-(Boc-amino)-4-fluoropiperidine (CAS# 1052713-46-8 ) is a useful research chemical.
Molecular Weight:	218.27
Molecular Formula:	C10H19FN2O2
Canonical SMILES:	CC(C)(C)OC(=O)NC1CNCCC1F
InChI:	InChI=1S/C10H19FN2O2/c1-10(2,3)15-9(14)13-8-6-12-5-4-7(8)11/h7-8,12H,4-6H2,1-3H3,(H,13,14)/t7-,8-/m1/s1
InChI Key:	PHKRFWRGEVHCAT-HTQZYQBOSA-N
LogP:	1.74430

Publication Number	Title	Priority Date
US-2020308145-A1	Benzimidazole derivatives and their uses	20171019
AU-2014308703-A1	Furo- and thieno-pyridine carboxamide compounds useful as Pim kinase inhibitors	20130823
US-2015057265-A1	Furo- and thieno-pyridine carboxamide compounds useful as pim kinase inhibitors	20130823
US-2014221344-A1	Bicyclic Pyridazine Compounds as PIM Inhibitors	20110429
US-9187486-B2	Bicyclic pyridazine compounds as Pim inhibitors	20110429

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Complexity:	228
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	218.14305602
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	218.14305602
Rotatable Bond Count:	3
Topological Polar Surface Area:	50.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1