N-(3-Piperidyl)methanesulfonamide - CAS 944068-21-7

Catalog:	BB041302
Product Name:	N-(3-Piperidyl)methanesulfonamide
CAS:	944068-21-7
Synonyms:	N-(3-piperidinyl)methanesulfonamide; N-piperidin-3-ylmethanesulfonamide

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	N-piperidin-3-ylmethanesulfonamide
Description:	N-(3-Piperidyl)methanesulfonamide (CAS# 944068-21-7) is a useful research chemical.
Molecular Weight:	178.25
Molecular Formula:	C6H14N2O2S
Canonical SMILES:	CS(=O)(=O)NC1CCCNC1
InChI:	InChI=1S/C6H14N2O2S/c1-11(9,10)8-6-3-2-4-7-5-6/h6-8H,2-5H2,1H3
InChI Key:	DHGIQFYIIZOGKF-UHFFFAOYSA-N
Appearance:	Solid
MDL:	MFCD09810664
LogP:	1.08810

Publication Number	Title	Priority Date
WO-2020146657-A1	Pi4-kinase inhibitors with anti-cancer activity	20190111
AU-2018357933-A1	Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors	20171031
EP-3551188-A1	Substituted quinazoline sulfonamides as thioredoxin interacting protein (txnip) inhibitors	20171031
US-2020038402-A1	Substituted quinazoline sulfonamides as thioredoxin interacting protein (txnip) inhibitors	20171031
WO-2019089693-A1	Substituted quinazoline sulfonamides as thioredoxin interacting protein (txnip) inhibitors	20171031

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Related Functional Groups

Carbonyl Compounds

[87-88-7]
Chloranilic acid
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	207
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.07759887
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	178.07759887
Rotatable Bond Count:	2
Topological Polar Surface Area:	66.6 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.5