| CAS Number | 926272-60-8 |
| Catalog Number | AG019N0C |
| Chemical Name | 2-(3,5-Dimethylpiperidine-1-carbonyl)aniline |
| IUPAC Name | (2-aminophenyl)-(3,5-dimethylpiperidin-1-yl)methanone |
| InChI | InChI=1S/C14H20N2O/c1-10-7-11(2)9-16(8-10)14(17)12-5-3-4-6-13(12)15/h3-6,10-11H,7-9,15H2,1-2H3 |
| InChI Key | HBRDSVZHQXKCKQ-UHFFFAOYSA-N |
| MDL Number | MFCD08361908 |
| Molecular Formula | C14H20N2O |
| Molecular Weight | 232.3214 |
| SMILES | CC1CN(C(C2=C(N)C=CC=C2)=O)CC(C)C1 |
| Synonyms | 2-(3,5-dimethylpiperidine-1-carbonyl)aniline,
2-[(3,5-dimethylpiperidin-1-yl)carbonyl]aniline,
926272-60-8,
2-aminophenyl 3,5-dimethylpiperidyl ketone,
AC1Q2QL9,
CTK6B4949,
SBB082540,
AKOS000126236,
AKOS016041855,
MCULE-1179905147,
NE19919,
ST50775293,
EN300-39078,
|
| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.327g/mol |
| Monoisotopic Mass | 232.158g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number