| CAS Number | 1251061-01-4 |
| Catalog Number | AG019PRO |
| Chemical Name | Methyl((1-[3-(pyridin-4-yl)phenyl]ethyl))amine |
| IUPAC Name | N-methyl-1-(3-pyridin-4-ylphenyl)ethanamine |
| InChI | InChI=1S/C14H16N2/c1-11(15-2)13-4-3-5-14(10-13)12-6-8-16-9-7-12/h3-11,15H,1-2H3 |
| InChI Key | QMZDQXMZRTWWMX-UHFFFAOYSA-N |
| MDL Number | MFCD12785863 |
| Molecular Formula | C14H16N2 |
| Molecular Weight | 212.2902 |
| SMILES | CNC(C1=CC(C2=CC=NC=C2)=CC=C1)C |
| Synonyms | methyl({1-[3-(pyridin-4-yl)phenyl]ethyl})amine,
1251061-01-4,
AKOS008145216,
NE48425,
EN300-86163,
Z1259161637,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.296g/mol |
| Monoisotopic Mass | 212.131g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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