3-Aminopiperidin-2-one - CAS 1892-22-4

Catalog:	BB014609
Product Name:	3-Aminopiperidin-2-one
CAS:	1892-22-4
Synonyms:	3-amino-2-piperidinone; 3-aminopiperidin-2-one

Technical Data

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Computed Properties

IUPAC Name:	3-aminopiperidin-2-one
Description:	3-Aminopiperidin-2-one (>90%) can be used as a biomarker to diagnose the silent phase of Alzeihmer's disease.
Molecular Weight:	114.15
Molecular Formula:	C5H10N2O
Canonical SMILES:	C1CC(C(=O)NC1)N
InChI:	InChI=1S/C5H10N2O/c6-4-2-1-3-7-5(4)8/h4H,1-3,6H2,(H,7,8)
InChI Key:	YCCMTCQQDULIFE-UHFFFAOYSA-N
Boiling Point:	307.5 °C at 760 mmHg
Density:	1.071 g/cm³
Appearance:	Solid
MDL:	MFCD06809610
LogP:	0.25280

Publication Number	Title	Priority Date
CN-113341034-A	Method for identifying producing area of oat in Heilongjiang	20210728
CN-111337620-A	Method for detecting content of 3-amino-2-piperidone in compound amino acid injection	20200509
WO-2021185949-A1	Plasticized polyamide molding compositions	20200320
CN-112812113-A	Immunomodulatory compounds, compositions and uses thereof	20191115
WO-2021093817-A1	Immunomodulatory compounds, composition and application thereof	20191115

PMID	Publication Date	Title	Journal
19213615	20090801	Identification and quantification of the atypical metabolite ornithine-lactam in human plasma by liquid chromatography-tandem mass spectrometry (LC-MS/MS)	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences
16018690	20050722	Synthesis of 4-substituted-3-aminopiperidin-2-ones: application to the synthesis of a conformationally constrained tetrapeptide N-acetyl-Ser-Asp-Lys-Pro	The Journal of organic chemistry
15162216	20040607	Design, synthesis and biological activity of a targeted library of potential tryptase inhibitors	Organic & biomolecular chemistry
15081344	20040401	Synthesis and evaluation of anti-apoptotic activity of L-carnitine cyclic analogues and amino acid derivatives	Farmaco (Societa chimica italiana : 1989)
12951087	20031006	Selective 3-amino-2-pyridinone acetamide thrombin inhibitors incorporating weakly basic partially saturated heterobicyclic P1-arginine mimetics	Bioorganic & medicinal chemistry letters

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word:	Warning

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	114.079312947
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	114.079312947
Rotatable Bond Count:	0
Topological Polar Surface Area:	55.1 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8