4-(Aminomethyl)-N-(pyridin-3-yl)benzamide Dihydrochloride - CAS 1158199-19-9
Catalog: |
BB073293 |
Product Name: |
4-(Aminomethyl)-N-(pyridin-3-yl)benzamide Dihydrochloride |
CAS: |
1158199-19-9 |
Synonyms: |
4-(aminomethyl)-N-(pyridin-3-yl)benzamide dihydrochloride; 4-(aminomethyl)-N-pyridin-3-ylbenzamide; dihydrochloride; 4-(aminomethyl)-N-(pyridin-3-yl)benzamidedihydrochloride; 4-(aminomethyl)-N-pyridin-3-ylbenzamide dihydrochloride |
IUPAC Name: | 4-(aminomethyl)-N-pyridin-3-ylbenzamidedihydrochloride |
Molecular Weight: | 300.18 |
Molecular Formula: | C13H13N3O·2HCl |
Canonical SMILES: | C1=CC(=CN=C1)NC(=O)C2=CC=C(C=C2)CN.Cl.Cl |
InChI: | InChI=1S/C13H13N3O.2ClH/c14-8-10-3-5-11(6-4-10)13(17)16-12-2-1-7-15-9-12/h1-7,9H,8,14H2,(H,16,17)2*1H |
InChI Key: | RWXOYWZHOWWURS-UHFFFAOYSA-N |
Complexity: | 249 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.0592175 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.0592175 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 68Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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