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1955492-55-3 | 3-methyl-5-[1-(pyrrolidine-2-carbonyl)pyrrolidin-2-yl]-1,2-oxazole hydrochloride
CAS No: 1955492-55-3 Catalog No: AG01B47U MDL No:MFCD30180549
Product Description
Catalog Number:
AG01B47U
Chemical Name:
3-methyl-5-[1-(pyrrolidine-2-carbonyl)pyrrolidin-2-yl]-1,2-oxazole hydrochloride
CAS Number:
1955492-55-3
Molecular Formula:
C13H20ClN3O2
Molecular Weight:
285.7698
MDL Number:
MFCD30180549
IUPAC Name:
[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone;hydrochloride
InChI:
InChI=1S/C13H19N3O2.ClH/c1-9-8-12(18-15-9)11-5-3-7-16(11)13(17)10-4-2-6-14-10;/h8,10-11,14H,2-7H2,1H3;1H
InChI Key:
ZFZPMWISIKDKRA-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1c1onc(c1)C)C1CCCN1.Cl
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.124g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.772g/mol
Monoisotopic Mass:
285.124g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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