| CAS Number | 1403595-07-2 |
| Catalog Number | AG019EZN |
| Chemical Name | 3-Aminomethyl-6-Methyl-4-Propyl-1H-Pyridin-2-One Hydrochloride |
| IUPAC Name | 3-(aminomethyl)-6-methyl-4-propyl-1H-pyridin-2-one;hydrochloride |
| InChI | InChI=1S/C10H16N2O.ClH/c1-3-4-8-5-7(2)12-10(13)9(8)6-11;/h5H,3-4,6,11H2,1-2H3,(H,12,13);1H |
| InChI Key | CMURGBNOIOKFRI-UHFFFAOYSA-N |
| MDL Number | MFCD31652793 |
| Molecular Formula | C10H17ClN2O |
| Molecular Weight | 216.7078 |
| SMILES | Cl.CCCc1cc(C)[nH]c(=O)c1CN |
| Synonyms | 1403595-07-2,
3-AMinoMethyl-6-Methyl-4-propyl-1H-pyridin-2-one hydrochloride,
3-(aminomethyl)-6-methyl-4-propylpyridin-2(1H)-one hydrochloride,
SCHEMBL13280706,
CMURGBNOIOKFRI-UHFFFAOYSA-N,
CS-0060054,
3-(Aminomethyl)-6-methyl-4-propyl-1,2-dihydropyridin-2-one HCl salt,
|
| Complexity | 277 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.709g/mol |
| Monoisotopic Mass | 216.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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