| CAS Number | 254102-05-1 |
| Catalog Number | AG01C511 |
| Chemical Name | (3S)-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| IUPAC Name | (3S)-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| InChI | InChI=1S/C11H14N2O/c1-12-11(14)10-6-8-4-2-3-5-9(8)7-13-10/h2-5,10,13H,6-7H2,1H3,(H,12,14)/t10-/m0/s1 |
| InChI Key | FPGCNHBNSLPKMJ-JTQLQIEISA-N |
| MDL Number | MFCD18165569 |
| Molecular Formula | C11H14N2O |
| Molecular Weight | 190.2417 |
| SMILES | CNC([C@H]1NCC2=C(C=CC=C2)C1)=O |
| Synonyms | (3S)-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide,
254102-05-1,
BBL010881,
MFCD18165569,
STK650301,
ZINC34933811,
AKOS005581291,
MCULE-9265848126,
CID10655298,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.246g/mol |
| Monoisotopic Mass | 190.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number