4-Piperidinecarboxamide - CAS 39546-32-2

Catalog:	BB024025
Product Name:	4-Piperidinecarboxamide
CAS:	39546-32-2
Synonyms:	piperidine-4-carboxamide

Technical Data

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Computed Properties

IUPAC Name:	piperidine-4-carboxamide
Description:	Anesthetic, analgesic, antimicrobial and cooling agent for prevention or treatment of skin irritation.
Molecular Weight:	128.17
Molecular Formula:	C6H12N2O
Canonical SMILES:	C1CNCCC1C(=O)N
InChI:	InChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)
InChI Key:	DPBWFNDFMCCGGJ-UHFFFAOYSA-N
Boiling Point:	311.7 ℃ at 760 mmHg
Purity:	97.0 %
Density:	1.06 g/cm³
Appearance:	White to off-white to light yellow crystalline powder
MDL:	MFCD00038012
LogP:	0.50040

Publication Number	Title	Priority Date
CN-113185451-A	Memantine urea derivative and preparation method and application thereof	20210428
CN-112125893-A	Small molecule compound with anti-filovirus function and application thereof	20200915
CN-111732575-A	N- (3- (pyrimidine-2-yl) phenyl) benzene sulfonamide derivative, pharmaceutical composition, preparation method and application	20200803
CN-111662280-A	Piperidinyl tetrahydrobenzothiazole oxime ether derivative and application thereof	20200717
WO-2021210586-A1	Condensed heterocyclic compound	20200414

PMID	Publication Date	Title	Journal
23009984	20121001	Behavioral and neurochemical profile of some novel phenacyl based isonipecotamide derivatives	Pakistan journal of pharmaceutical sciences
22412562	20120301	rac-4-Carbamoylpiperidinium cis-2-car-boxy-cyclo-hexane-1-carboxyl-ate	Acta crystallographica. Section E, Structure reports online
22090967	20110801	2,2,6,6-Tetra-methyl-4-oxopiperidin-1-ium 4-chloro-3-nitro-benzoate	Acta crystallographica. Section E, Structure reports online
21727637	20110701	Proton-transfer compounds of isonipecotamide with the aromatic dicarboxylic acids 4-nitrophthalic, 4,5-dichlorophthalic, 5-nitroisophthalic and terephthalic acid	Acta crystallographica. Section C, Crystal structure communications
21522329	20110205	4-Carbamoylpiperidinium 2-carb-oxy-benzoate-benzene-1,2-dicarb-oxy-lic acid (1/1)	Acta crystallographica. Section E, Structure reports online

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Related Functional Groups

Piperidines

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Ethyl 1-((1-methyl-1H-pyrazol-4-yl)sulfonyl)piperidine-3-carboxylate
[1189664-19-4]
Ethyl 1-(3-chlorobenzyl)piperidine-3-carboxylate hydrochloride
[349625-89-4]
Ethyl 1-(methylsulfonyl)piperidine-3-carboxylate
[1172760-90-5]
Ethyl 1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]piperidine-3-carboxylate
[1006334-33-3]
Ethyl 1-[(1-ethyl-1H-pyrazol-4-yl)methyl]piperidine-4-carboxylate

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	108
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.094963011
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	128.094963011
Rotatable Bond Count:	1
Topological Polar Surface Area:	55.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.4