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1466694-74-5 | 2,2-dimethyl-1-[2-(pyridin-3-yl)pyrrolidin-1-yl]propan-1-one
CAS No: 1466694-74-5 Catalog No: AG01BBTQ MDL No:MFCD21415797
Product Description
Catalog Number:
AG01BBTQ
Chemical Name:
2,2-dimethyl-1-[2-(pyridin-3-yl)pyrrolidin-1-yl]propan-1-one
CAS Number:
1466694-74-5
Molecular Formula:
C14H20N2O
Molecular Weight:
232.3214
MDL Number:
MFCD21415797
IUPAC Name:
2,2-dimethyl-1-(2-pyridin-3-ylpyrrolidin-1-yl)propan-1-one
InChI:
InChI=1S/C14H20N2O/c1-14(2,3)13(17)16-9-5-7-12(16)11-6-4-8-15-10-11/h4,6,8,10,12H,5,7,9H2,1-3H3
InChI Key:
PCKDUVFFSDAJTO-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)N1CCCC1c1cccnc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.327g/mol
Monoisotopic Mass:
232.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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