(S)-3-Methyl-5-(2-pyrrolidinyl)-1,2,4-oxadiazole - CAS 343246-61-7

Catalog:	BB022068
Product Name:	(S)-3-Methyl-5-(2-pyrrolidinyl)-1,2,4-oxadiazole
CAS:	343246-61-7
Synonyms:	3-methyl-5-[(2S)-2-pyrrolidinyl]-1,2,4-oxadiazole; 3-methyl-5-[(2S)-pyrrolidin-2-yl]-1,2,4-oxadiazole

Technical Data

Patents

Computed Properties

IUPAC Name:	3-methyl-5-[(2S)-pyrrolidin-2-yl]-1,2,4-oxadiazole
Description:	(S)-3-Methyl-5-(2-pyrrolidinyl)-1,2,4-oxadiazole (CAS# 343246-61-7) is a useful research chemical.
Molecular Weight:	153.18
Molecular Formula:	C7H11N3O
Canonical SMILES:	CC1=NOC(=N1)C2CCCN2
InChI:	InChI=1S/C7H11N3O/c1-5-9-7(11-10-5)6-3-2-4-8-6/h6,8H,2-4H2,1H3/t6-/m0/s1
InChI Key:	HVPGJKMIHQOPDG-LURJTMIESA-N
LogP:	1.13130

Publication Number	Title	Priority Date
WO-2020233618-A1	Inhibitors for programmed cell necrosis and preparation method therefor and use thereof	20190521
US-2017298032-A1	Sphingosine kinase inhibitors	20141001
US-2015252032-A1	Orexin receptor antagonists which are [ortho bi-(hetero-)aryl]-[2-(meta bi-(hetero-)aryl)-pyrrolidin-1-yl]-methanone derivatives	20121010
US-9493446-B2	Orexin receptor antagonists which are [ortho bi-(hetero-)aryl]-[2-(meta bi-(hetero-)aryl)-pyrrolidin-1-yl]-methanone derivatives	20121010
EP-2238128-A2	Heterocyclic pyrazole-carboxamides as p2y12 antagonists	20071226

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Related Functional Groups

Pyrrolidines

[1427004-19-0]
DBCO-PEG4-NHS ester
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[55727-59-8]
2-(Pyrrolidin-1-ylmethyl)aniline
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[1497778-22-9]
Tert-butyl 3-hydroxy-2,2-dimethylpyrrolidine-1-carboxylate
[54716-02-8]
Ethyl (E)-3-(1-pyrrolidinyl)crotonate

Complexity:	142
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	153.090211983
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.090211983
Rotatable Bond Count:	1
Topological Polar Surface Area:	51
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5