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114212-83-8 | 1-Pyrrolidinecarboximidamide, N-(3-methyl-1,2,4-oxadiazol-5-yl)-
CAS No: 114212-83-8 Catalog No: AG000AT4 MDL No:
Product Description
Catalog Number:
AG000AT4
Chemical Name:
1-Pyrrolidinecarboximidamide, N-(3-methyl-1,2,4-oxadiazol-5-yl)-
CAS Number:
114212-83-8
Molecular Formula:
C8H13N5O
Molecular Weight:
195.2217
IUPAC Name:
N'-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidine-1-carboximidamide
InChI:
InChI=1S/C8H13N5O/c1-6-10-8(14-12-6)11-7(9)13-4-2-3-5-13/h2-5H2,1H3,(H2,9,10,11,12)
InChI Key:
PIINYFHNSMVTLG-UHFFFAOYSA-N
SMILES:
N=C(N1CCCC1)Nc1onc(n1)C
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.112g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.226g/mol
Monoisotopic Mass:
195.112g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.4
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