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1224708-45-5 | Ethanone, 1-[4-(4-amino-3-methoxyphenyl)-1-piperidinyl]-
CAS No: 1224708-45-5 Catalog No: AG0017A0 MDL No:MFCD17392803
Product Description
Catalog Number:
AG0017A0
Chemical Name:
Ethanone, 1-[4-(4-amino-3-methoxyphenyl)-1-piperidinyl]-
CAS Number:
1224708-45-5
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
MDL Number:
MFCD17392803
IUPAC Name:
1-[4-(4-amino-3-methoxyphenyl)piperidin-1-yl]ethanone
InChI:
InChI=1S/C14H20N2O2/c1-10(17)16-7-5-11(6-8-16)12-3-4-13(15)14(9-12)18-2/h3-4,9,11H,5-8,15H2,1-2H3
InChI Key:
GJAFOGNDCITKSP-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1N)C1CCN(CC1)C(=O)C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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