Home Other Building Blocks 5-ethyl-3-(pyrrolidin-2-yl)-1,2,4-oxadiazole

5-ethyl-3-(pyrrolidin-2-yl)-1,2,4-oxadiazole

CAS No.:
1376392-03-8
Catalog Number:
AG01A8UE
Molecular Formula:
C8H13N3O
Molecular Weight:
167.2083
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Product Description
Catalog Number:
AG01A8UE
Chemical Name:
5-ethyl-3-(pyrrolidin-2-yl)-1,2,4-oxadiazole
CAS Number:
1376392-03-8
Molecular Formula:
C8H13N3O
Molecular Weight:
167.2083
MDL Number:
MFCD18265354
IUPAC Name:
5-ethyl-3-pyrrolidin-2-yl-1,2,4-oxadiazole
InChI:
InChI=1S/C8H13N3O/c1-2-7-10-8(11-12-7)6-4-3-5-9-6/h6,9H,2-5H2,1H3
InChI Key:
PQCIDCRGPNBLBJ-UHFFFAOYSA-N
SMILES:
CCc1onc(n1)C1CCCN1
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.106g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.212g/mol
Monoisotopic Mass:
167.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties