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Home > Pyridines > 100948-48-9
100948-48-9 | 3-Pyridinecarboxamide, 2-methoxy-N-(2-phenylethyl)-
CAS No: 100948-48-9 Catalog No: AG0003A2 MDL No:
Product Description
Catalog Number:
AG0003A2
Chemical Name:
3-Pyridinecarboxamide, 2-methoxy-N-(2-phenylethyl)-
CAS Number:
100948-48-9
Molecular Formula:
C15H16N2O2
Molecular Weight:
256.2997
IUPAC Name:
2-methoxy-N-(2-phenylethyl)pyridine-3-carboxamide
InChI:
InChI=1S/C15H16N2O2/c1-19-15-13(8-5-10-17-15)14(18)16-11-9-12-6-3-2-4-7-12/h2-8,10H,9,11H2,1H3,(H,16,18)
InChI Key:
AOMHSLZAFSBHFJ-UHFFFAOYSA-N
SMILES:
COc1ncccc1C(=O)NCCc1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.121g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.305g/mol
Monoisotopic Mass:
256.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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