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88069-54-9 | 1H-Pyrrolizine-7a(5H)-acetamide, N-(2,6-diethylphenyl)tetrahydro-
CAS No: 88069-54-9 Catalog No: AG004EXL MDL No:
Product Description
Catalog Number:
AG004EXL
Chemical Name:
1H-Pyrrolizine-7a(5H)-acetamide, N-(2,6-diethylphenyl)tetrahydro-
CAS Number:
88069-54-9
Molecular Formula:
C19H28N2O
Molecular Weight:
300.4384
IUPAC Name:
N-(2,6-diethylphenyl)-2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetamide
InChI:
InChI=1S/C19H28N2O/c1-3-15-8-5-9-16(4-2)18(15)20-17(22)14-19-10-6-12-21(19)13-7-11-19/h5,8-9H,3-4,6-7,10-14H2,1-2H3,(H,20,22)
InChI Key:
SGBXCMYLPMTGAA-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1NC(=O)CC12CCCN2CCC1)CC
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.22g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
300.446g/mol
Monoisotopic Mass:
300.22g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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