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247592-56-9 | N-(4-Iodo-2-methyl-phenyl)-2-piperidin-1-yl-acetamide
CAS No: 247592-56-9 Catalog No: AG01F8BY MDL No:
Product Description
Catalog Number:
AG01F8BY
Chemical Name:
N-(4-Iodo-2-methyl-phenyl)-2-piperidin-1-yl-acetamide
CAS Number:
247592-56-9
Molecular Formula:
C14H19IN2O
Molecular Weight:
358.2179
IUPAC Name:
N-(4-iodo-2-methylphenyl)-2-piperidin-1-ylacetamide
InChI:
InChI=1S/C14H19IN2O/c1-11-9-12(15)5-6-13(11)16-14(18)10-17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,18)
InChI Key:
NTKAAGQKWNVDOO-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1C)I)CN1CCCCC1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.054g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.223g/mol
Monoisotopic Mass:
358.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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