N,N-Diethylnipecotamide - CAS 3367-95-1

Catalog:	BB021818
Product Name:	N,N-Diethylnipecotamide
CAS:	3367-95-1
Synonyms:	N,N-diethylpiperidine-3-carboxamide

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	N,N-diethylpiperidine-3-carboxamide
Description:	N,N-Diethylnipecotamide (CAS# 3367-95-1) is a useful research chemical.
Molecular Weight:	184.28
Molecular Formula:	C10H20N2O
Canonical SMILES:	CCN(CC)C(=O)C1CCCNC1
InChI:	InChI=1S/C10H20N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h9,11H,3-8H2,1-2H3
InChI Key:	ZXQKYQVJDRTTLZ-UHFFFAOYSA-N
Boiling Point:	309.2 °C at 760 mmHg
Density:	0.989 g/cm³
Appearance:	Clear colourless to yellow liquid
MDL:	MFCD00005990
LogP:	1.18320

Publication Number	Title	Priority Date
BR-112020011979-A2	amide-substituted indole compounds useful as tlr inhibitors	20171219
CN-111511730-A	Amide substituted indole compounds useful as T L R inhibitors	20171219
EP-3728221-A1	Amide substituted indole compounds useful as tlr inhibitors	20171219
US-2020331920-A1	Amide substituted indole compounds useful as tlr inhibitors	20171219
JP-2021506923-A	Amide-substituted indole compounds useful as TLR inhibitors	20171219

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[1427004-19-0]
DBCO-PEG4-NHS ester
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

Piperidines

[874800-64-3]
1-(4-Chloro-2-nitrophenyl)piperidine-4-carboxylic acid
[2091522-65-3]
tert-butyl 3-cyano-5-hydroxypiperidine-1-carboxylate
[758720-54-6]
1-(3-Nitropyridin-2-yl)piperidine-4-carboxylic acid
[313685-03-9]
Ethyl 1-[(4-chlorophenyl)sulfonyl]piperidine-4-carboxylate
[1189664-19-4]
Ethyl 1-(3-chlorobenzyl)piperidine-3-carboxylate hydrochloride
[610259-52-4]
Ethyl 1-(thiophen-2-ylsulfonyl)piperidine-3-carboxylate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	166
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.157563266
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	184.157563266
Rotatable Bond Count:	3
Topological Polar Surface Area:	32.3 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1