N-Methyl-1-(pyrimidin-2-yl)methanamine Hydrochloride
Catalog: |
BB076227 |
Product Name: |
N-Methyl-1-(pyrimidin-2-yl)methanamine Hydrochloride |
Synonyms: |
N-Methyl-1-(pyrimidin-2-yl)methanamine hydrochloride; N-METHYL-2-PYRIMIDINEMETHANAMINE HCL; N-Methyl-1-(pyrimidin-2-yl)methanaminehydrochloride; N-METHYL-2-PYRIMIDINEMETHANAMINE HYDROCHLORIDE |
IUPAC Name: | N-methyl-1-pyrimidin-2-ylmethanaminehydrochloride |
Description: | N-Methyl-1-(pyrimidin-2-yl)methanamine Hydrochloride is a salt analog of N-Methyl-1-(pyrimidin-2-yl)methanamine (CAS# 1083246-53-0), which may be useful in the preparation of (hetero)arylalkylamino-pyrazolopyridazine derivatives having multimodal activity against pain. |
Molecular Weight: | 159.62 |
Molecular Formula: | C6H9N3·HCl |
Canonical SMILES: | CNCC1=NC=CC=N1.Cl |
InChI: | InChI=1S/C6H9N3.ClH/c1-7-5-6-8-3-2-4-9-6/h2-4,7H,5H2,1H31H |
InChI Key: | NYRKIRRMUHUJAZ-UHFFFAOYSA-N |
References: | Yenes-Minguez, S., et al. PCT Int. Appl., WO 2018219927, 173pp. (2018). |
Complexity: | 68.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 159.056325 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 159.056325 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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