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88061-29-4 | Butanamide, N-(3-ethyl-1,2-dihydro-6-methyl-2-oxo-4-pyridinyl)-
CAS No: 88061-29-4 Catalog No: AG004IEE MDL No:
Product Description
Catalog Number:
AG004IEE
Chemical Name:
Butanamide, N-(3-ethyl-1,2-dihydro-6-methyl-2-oxo-4-pyridinyl)-
CAS Number:
88061-29-4
Molecular Formula:
C12H18N2O2
Molecular Weight:
222.2835
IUPAC Name:
N-(3-ethyl-6-methyl-2-oxo-1H-pyridin-4-yl)butanamide
InChI:
InChI=1S/C12H18N2O2/c1-4-6-11(15)14-10-7-8(3)13-12(16)9(10)5-2/h7H,4-6H2,1-3H3,(H2,13,14,15,16)
InChI Key:
DVIGRFMZKMSUKV-UHFFFAOYSA-N
SMILES:
CCCC(=O)Nc1cc(C)[nH]c(=O)c1CC
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.288g/mol
Monoisotopic Mass:
222.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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