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Home > Pyridines > 115064-49-8
115064-49-8 | Butanamide, 3-oxo-N-(2-pyridinylmethyl)-
CAS No: 115064-49-8 Catalog No: AG000FV6 MDL No:
Product Description
Catalog Number:
AG000FV6
Chemical Name:
Butanamide, 3-oxo-N-(2-pyridinylmethyl)-
CAS Number:
115064-49-8
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
IUPAC Name:
3-oxo-N-(pyridin-2-ylmethyl)butanamide
InChI:
InChI=1S/C10H12N2O2/c1-8(13)6-10(14)12-7-9-4-2-3-5-11-9/h2-5H,6-7H2,1H3,(H,12,14)
InChI Key:
UVXCXLOTBZOCHF-UHFFFAOYSA-N
SMILES:
O=C(CC(=O)C)NCc1ccccn1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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