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Home > Pyridines > 113975-36-3
113975-36-3 | Propanamide, 2,2-dimethyl-N-[3-(2-oxopropyl)-4-pyridinyl]-
CAS No: 113975-36-3 Catalog No: AG000A7Z MDL No:
Product Description
Catalog Number:
AG000A7Z
Chemical Name:
Propanamide, 2,2-dimethyl-N-[3-(2-oxopropyl)-4-pyridinyl]-
CAS Number:
113975-36-3
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
IUPAC Name:
2,2-dimethyl-N-[3-(2-oxopropyl)pyridin-4-yl]propanamide
InChI:
InChI=1S/C13H18N2O2/c1-9(16)7-10-8-14-6-5-11(10)15-12(17)13(2,3)4/h5-6,8H,7H2,1-4H3,(H,14,15,17)
InChI Key:
WXXVUFNVFSXYCK-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1cnccc1NC(=O)C(C)(C)C
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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