| CAS Number | 953892-79-0 |
| Catalog Number | AG019MM4 |
| Chemical Name | 2-(2,6-dimethylpiperidine-1-carbonyl)-4,5-dimethoxyaniline |
| IUPAC Name | (2-amino-4,5-dimethoxyphenyl)-(2,6-dimethylpiperidin-1-yl)methanone |
| InChI | InChI=1S/C16H24N2O3/c1-10-6-5-7-11(2)18(10)16(19)12-8-14(20-3)15(21-4)9-13(12)17/h8-11H,5-7,17H2,1-4H3 |
| InChI Key | XROHDCHIGKJPAL-UHFFFAOYSA-N |
| MDL Number | MFCD09729555 |
| Molecular Formula | C16H24N2O3 |
| Molecular Weight | 292.3734 |
| SMILES | COC1=C(OC)C=C(C(N2C(C)CCCC2C)=O)C(N)=C1 |
| Synonyms | 2-(2,6-dimethylpiperidine-1-carbonyl)-4,5-dimethoxyaniline,
953892-79-0,
2-[(2,6-dimethylpiperidin-1-yl)carbonyl]-4,5-dimethoxyaniline,
AC1Q46IA,
CTK6J5333,
AKOS000138679,
AKOS016900731,
MCULE-3364440263,
NE21372,
EN300-36582,
Z370706542,
|
| Complexity | 353 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 292.379g/mol |
| Monoisotopic Mass | 292.179g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number