| CAS Number | 1158534-34-9 |
| Catalog Number | AG00J3IL |
| Chemical Name | N-(3-pyridinylmethyl)cycloheptanamine hydrochloride |
| IUPAC Name | N-(pyridin-3-ylmethyl)cycloheptanamine;hydrochloride |
| InChI | InChI=1S/C13H20N2.ClH/c1-2-4-8-13(7-3-1)15-11-12-6-5-9-14-10-12;/h5-6,9-10,13,15H,1-4,7-8,11H2;1H |
| InChI Key | GXLJUDQFJYJVRF-UHFFFAOYSA-N |
| MDL Number | MFCD07110858 |
| Molecular Formula | C13H21ClN2 |
| Molecular Weight | 240.7722 |
| SMILES | N1=CC=CC(CNC2CCCCCC2)=C1.Cl |
| Synonyms | N-(3-PYRIDINYLMETHYL)CYCLOHEPTANAMINE HYDROCHLORIDE,
1158534-34-9,
ZX-CM015578,
MFCD07110858,
N-(PYRIDIN-3-YLMETHYL)CYCLOHEPTANAMINE HYDROCHLORIDE,
179055-42-6,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.139g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.775g/mol |
| Monoisotopic Mass | 240.139g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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