Home Aminos 3-methoxy-2-methyl-5-[(methylamino)methyl]-1,4-dihydropyridin-4-one dihydrochloride

3-methoxy-2-methyl-5-[(methylamino)methyl]-1,4-dihydropyridin-4-one dihydrochloride

CAS No.:
2044713-12-2
Catalog Number:
AG01BXTM
Molecular Formula:
C9H16Cl2N2O2
Molecular Weight:
255.1415
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Product Description
Catalog Number:
AG01BXTM
Chemical Name:
3-methoxy-2-methyl-5-[(methylamino)methyl]-1,4-dihydropyridin-4-one dihydrochloride
CAS Number:
2044713-12-2
Molecular Formula:
C9H16Cl2N2O2
Molecular Weight:
255.1415
MDL Number:
MFCD30488027
IUPAC Name:
3-methoxy-2-methyl-5-(methylaminomethyl)-1H-pyridin-4-one;dihydrochloride
InChI:
InChI=1S/C9H14N2O2.2ClH/c1-6-9(13-3)8(12)7(4-10-2)5-11-6;;/h5,10H,4H2,1-3H3,(H,11,12);2*1H
InChI Key:
CAQQCFNRJPYVKV-UHFFFAOYSA-N
SMILES:
CNCc1c[nH]c(c(c1=O)OC)C.Cl.Cl
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.059g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
255.139g/mol
Monoisotopic Mass:
254.059g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties