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1270597-15-3 | 3-methyl-5-[1-(pyrrolidine-2-carbonyl)pyrrolidin-2-yl]-1,2-oxazole
CAS No: 1270597-15-3 Catalog No: AG01B47V MDL No:MFCD12885439
Product Description
Catalog Number:
AG01B47V
Chemical Name:
3-methyl-5-[1-(pyrrolidine-2-carbonyl)pyrrolidin-2-yl]-1,2-oxazole
CAS Number:
1270597-15-3
Molecular Formula:
C13H19N3O2
Molecular Weight:
249.3089
MDL Number:
MFCD12885439
IUPAC Name:
[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone
InChI:
InChI=1S/C13H19N3O2/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
InChI Key:
RZCVOCKESCVREI-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1c1onc(c1)C)C1CCCN1
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.148g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.314g/mol
Monoisotopic Mass:
249.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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